data_2l4f_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 2l4f _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 ' 12' ' ' SER . . . . . 0.49 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 111.495 0.183 . . . . 0.0 111.495 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -64.29 -24.92 64.7 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.856 3.037 . . . . 0.0 109.927 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -92.55 -45.75 7.96 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.104 176.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.49 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.4 mm-40 -69.41 -13.49 62.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.727 -175.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.94 -14.47 59.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.73 -49.77 3.11 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 171.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt -58.6 -50.72 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.103 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.69 -20.97 61.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.571 -1.252 . . . . 0.0 111.201 -175.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.1 t -82.51 -32.16 28.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -81.33 -58.18 3.16 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.3 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -58.38 -26.88 63.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.031 0.932 . . . . 0.0 112.567 -179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.9 m -83.03 -28.49 29.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 118.711 0.687 . . . . 0.0 111.562 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.5 tp -83.95 -14.91 49.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.023 0.529 . . . . 0.0 111.757 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 p -121.91 -0.72 9.5 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.299 0.639 . . . . 0.0 111.927 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp 63.45 11.77 5.83 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 169.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.3 p -86.99 -172.57 4.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.979 0.512 . . . . 0.0 110.652 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.15 145.58 40.81 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.6 -23.81 34.02 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.309 2.673 . . . . 0.0 113.845 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -83.85 -12.12 56.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.494 0.318 . . . . 0.0 111.277 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.04 -39.04 13.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.0 t -57.81 -44.68 86.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 174.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -55.66 -23.88 30.67 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.912 1.285 . . . . 0.0 112.091 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -102.5 -6.51 22.81 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 120.052 1.296 . . . . 0.0 112.679 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.429 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -103.06 -16.22 15.84 Favored 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.8 mt -80.21 -39.58 28.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -68.0 -11.85 59.66 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -87.49 -12.78 44.96 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.631 0.372 . . . . 0.0 111.127 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -141.23 36.29 1.71 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.832 0.453 . . . . 0.0 111.37 -171.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 47.75 42.33 15.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 112.327 176.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 26.6 m95 50.86 35.77 13.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.524 1.53 . . . . 0.0 112.925 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -91.65 118.17 30.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tt -73.84 -18.16 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.805 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -84.75 -41.77 15.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -70.67 -36.94 73.58 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.81 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -26.83 61.36 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.523 0.329 . . . . 0.0 111.364 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.4 mt -76.63 -34.75 58.31 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 117.967 0.349 . . . . 0.0 110.392 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.04 -34.37 71.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.87 -40.38 72.31 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 122.2 -0.313 . . . . 0.0 110.274 178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.429 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 28.2 t80 -68.95 -37.63 78.94 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.554 -0.716 . . . . 0.0 111.02 177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -73.19 -8.98 58.16 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 122.288 -0.257 . . . . 0.0 110.35 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.53 0.209 0 C-N-CA 122.24 0.216 . . . . 0.0 111.063 175.238 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.578 0 CA-C-O 120.919 0.39 . . . . 0.0 110.195 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.8 Cg_exo -68.01 -28.89 34.73 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.338 4.025 . . . . 0.0 111.924 -174.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.439 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 30.6 mt-10 -93.29 -32.98 14.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.457 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.81 -15.8 61.17 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.157 0.583 . . . . 0.0 111.034 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -80.25 -13.67 59.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -107.5 -49.1 3.31 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.653 169.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.9 mt -60.21 -49.55 83.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.169 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -72.98 -21.14 60.89 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.123 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -81.87 -33.31 30.63 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -80.48 -59.29 2.75 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.707 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -56.26 -29.1 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.436 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -82.01 -28.26 32.65 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.113 0.87 . . . . 0.0 111.819 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.9 tp -83.65 -17.54 41.15 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.741 0.416 . . . . 0.0 111.92 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.3 p -121.23 -0.33 9.94 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 122.999 0.519 . . . . 0.0 111.675 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.1 11.75 5.47 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 169.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.4 p -86.73 -169.7 2.75 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.222 0.609 . . . . 0.0 111.098 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -88.87 145.14 34.12 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -54.07 -24.2 31.88 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.529 2.82 . . . . 0.0 114.136 -177.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 -16.97 45.78 Favored 'General case' 0 CA--C 1.522 -0.133 0 O-C-N 121.998 -0.439 . . . . 0.0 110.933 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.7 t -81.73 -35.63 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.0 t -60.52 -48.85 79.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -49.39 -57.75 6.37 Favored 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 124.727 1.211 . . . . 0.0 110.214 176.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -65.79 -13.95 60.45 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 16.0 m-85 -102.19 -18.61 15.44 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.459 1.027 . . . . 0.0 109.981 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 34.0 mt -76.63 -34.95 58.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -67.14 -15.96 64.03 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.848 0.459 . . . . 0.0 111.719 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.2 mtp85 -87.86 -10.49 50.6 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.772 0.829 . . . . 0.0 111.094 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -141.03 34.47 1.74 Allowed 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.874 0.47 . . . . 0.0 111.374 -172.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 46.95 40.25 8.97 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.484 0.714 . . . . 0.0 112.183 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.439 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 23.4 m95 52.1 36.77 19.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 125.541 1.536 . . . . 0.0 113.153 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -92.15 120.25 32.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 172.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tt -74.61 -18.44 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 119.058 -1.057 . . . . 0.0 111.603 -170.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -84.4 -42.12 16.0 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -69.9 -37.94 76.16 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.915 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.52 -25.78 60.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 122.612 0.365 . . . . 0.0 111.386 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.9 mt -77.32 -33.41 55.56 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 118.009 0.368 . . . . 0.0 110.292 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -72.22 -34.65 68.5 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 122.033 -0.417 . . . . 0.0 110.06 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -70.14 -38.0 75.39 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 178.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 54.8 t80 -69.52 -41.81 75.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 121.72 -0.612 . . . . 0.0 111.491 177.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -69.54 -11.24 60.67 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 117.891 0.314 . . . . 0.0 110.328 176.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.53 0.18 0 C-N-CA 122.551 0.34 . . . . 0.0 110.865 175.925 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.523 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 121.02 0.438 . . . . 0.0 110.764 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.4 Cg_exo -66.48 -28.78 45.58 Favored 'Trans proline' 0 N--CA 1.456 -0.693 1 C-N-CA 125.632 4.221 . . . . 0.0 112.015 -173.34 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.461 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 59.2 mt-10 -95.2 -31.36 13.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.735 176.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -76.69 -12.22 59.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 123.497 0.498 . . . . 0.0 110.791 -175.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -82.52 -14.65 54.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.74 -49.25 3.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.977 169.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -60.31 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.88 -176.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.44 -20.59 61.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.049 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 t -83.35 -30.38 27.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -83.3 -59.19 2.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.377 1.071 . . . . 0.0 109.75 -176.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.8 t -56.11 -28.79 59.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.547 178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.8 m -83.31 -29.63 28.17 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 119.244 0.929 . . . . 0.0 112.018 175.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -81.24 -16.56 52.31 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.587 0.355 . . . . 0.0 111.108 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -120.62 -1.95 9.99 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.148 0.579 . . . . 0.0 112.016 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp 62.81 10.36 4.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.0 p -89.98 -164.02 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.72 0.808 . . . . 0.0 111.503 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -91.11 144.92 30.66 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.733 0.813 . . . . 0.0 110.427 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.58 -22.27 27.63 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.137 2.558 . . . . 0.0 113.669 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -77.95 -31.35 50.84 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.7 p -83.75 -25.43 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.139 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.3 t -61.82 -51.27 68.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.3 ttt85 -51.4 -58.78 5.3 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 125.386 1.475 . . . . 0.0 110.585 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -63.06 -17.84 62.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -176.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.435 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 11.7 m-85 -100.42 -18.11 16.88 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.373 0.988 . . . . 0.0 110.245 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.4 mt -75.25 -34.81 61.43 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 172.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -67.55 -14.69 63.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.858 0.463 . . . . 0.0 111.55 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -90.18 -9.65 47.39 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 124.036 0.935 . . . . 0.0 111.355 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -140.28 33.74 1.89 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.909 0.484 . . . . 0.0 111.362 -172.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.8 p80 49.01 35.54 7.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.347 1.059 . . . . 0.0 112.489 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 21.0 m95 56.06 38.26 29.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.681 1.593 . . . . 0.0 112.416 -178.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -88.99 120.12 30.12 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 171.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -75.14 -17.83 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 118.757 -1.177 . . . . 0.0 111.775 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.11 -41.0 16.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -176.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.7 -38.41 73.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.024 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.67 -26.54 61.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.487 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.1 mt -76.63 -35.07 58.25 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.01 0.368 . . . . 0.0 110.162 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.6 -36.3 70.79 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -69.4 -40.67 77.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.435 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 64.3 t80 -68.83 -41.22 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.767 -0.583 . . . . 0.0 111.274 177.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -69.53 -8.32 46.11 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 117.651 0.205 . . . . 0.0 110.641 175.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 CA--C 1.531 0.238 0 C-N-CA 122.179 0.192 . . . . 0.0 110.943 175.452 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.506 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.522 0 CA-C-O 121.342 0.592 . . . . 0.0 111.213 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.4 Cg_exo -67.43 -28.6 38.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.329 4.02 . . . . 0.0 111.602 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.451 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 29.3 mt-10 -92.84 -32.31 14.67 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.381 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -76.63 -13.65 60.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.752 0.421 . . . . 0.0 111.186 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -82.55 -12.34 57.82 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.17 -50.12 3.04 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 28.9 mt -57.82 -48.79 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 CA-C-O 118.736 -0.649 . . . . 0.0 112.295 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -74.08 -20.94 60.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.111 -175.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -82.83 -31.52 28.03 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -82.63 -56.29 3.94 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.27 -175.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -58.44 -28.05 64.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.144 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 m -81.34 -27.96 34.7 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.992 0.815 . . . . 0.0 111.983 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.5 tp -86.66 -20.01 28.42 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.071 0.548 . . . . 0.0 111.877 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.9 p -110.05 -4.03 16.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 123.319 0.648 . . . . 0.0 111.302 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.1 mmtt 63.03 11.56 5.25 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.509 0.505 . . . . 0.0 111.649 169.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.0 t -93.15 -164.31 1.16 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.222 1.009 . . . . 0.0 109.926 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -96.84 145.53 29.74 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 122.92 0.488 . . . . 0.0 110.303 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -54.06 -17.83 12.09 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.592 2.862 . . . . 0.0 114.509 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -83.66 -10.09 58.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.893 0.77 . . . . 0.0 111.844 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -96.94 -36.48 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.8 t -52.62 -52.17 56.68 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.463 0.649 . . . . 0.0 109.763 177.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -59.89 -36.42 76.91 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.676 -176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -77.19 -11.56 59.83 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 119.373 0.988 . . . . 0.0 112.724 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.439 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 17.3 m-85 -102.32 -20.51 14.58 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 118.967 0.803 . . . . 0.0 109.682 172.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -76.23 -37.13 58.09 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -68.49 -12.99 62.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.237 0.615 . . . . 0.0 111.324 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -90.07 -10.55 44.34 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 123.695 0.798 . . . . 0.0 111.388 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -140.17 30.38 1.99 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.814 0.445 . . . . 0.0 111.593 -171.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 53.56 32.12 13.71 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 123.705 0.802 . . . . 0.0 112.584 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.451 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 18.8 m95 58.9 31.93 21.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.723 1.209 . . . . 0.0 112.776 -178.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -84.6 114.01 21.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 172.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -71.87 -16.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 C-N-CA 118.744 -1.182 . . . . 0.0 111.636 -169.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -84.85 -42.71 14.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -68.26 -40.39 81.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.662 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.89 63.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.567 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.85 -34.7 62.33 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.058 0.39 . . . . 0.0 110.273 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -72.29 -29.45 63.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -78.51 -17.54 56.08 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.122 0.569 . . . . 0.0 111.194 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 40.3 t80 -92.59 -37.87 12.21 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.668 1.187 . . . . 0.0 111.006 172.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -66.93 -14.42 62.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.902 0.382 . . . . 0.0 111.19 178.378 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.476 ' HB3' ' CG ' ' A' ' 15' ' ' GLN . 1.3 t . . . . . 0 CA--C 1.528 0.114 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -62.31 -25.22 76.4 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.825 3.017 . . . . 0.0 109.899 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -91.54 -45.41 8.52 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 113.849 -1.523 . . . . 0.0 109.821 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.476 ' CG ' ' HB3' ' A' ' 12' ' ' SER . 9.9 mm-40 -70.22 -12.87 61.89 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.827 0.451 . . . . 0.0 111.507 -174.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -80.58 -13.24 59.23 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.717 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.11 -46.83 3.17 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 171.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.45 HG23 ' HG ' ' A' ' 32' ' ' SER . 7.4 mt -58.35 -51.97 64.79 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 118.898 -0.572 . . . . 0.0 111.377 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.11 -22.27 61.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.131 -174.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 t -81.37 -33.38 32.39 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -78.65 -61.66 1.94 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.552 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -54.15 -27.26 32.4 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 112.898 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.2 m -84.24 -28.35 27.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 118.947 0.794 . . . . 0.0 111.564 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.0 tp -83.84 -16.58 43.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.742 0.417 . . . . 0.0 111.685 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 p -118.7 -1.62 11.08 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.314 0.645 . . . . 0.0 111.607 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp 63.24 12.42 6.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.353 0.408 . . . . 0.0 112.036 169.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.45 -177.36 6.17 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 122.985 0.514 . . . . 0.0 111.104 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -80.93 146.52 59.58 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.31 -7.91 4.49 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.985 3.123 . . . . 0.0 114.756 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -101.64 -11.2 19.38 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 118.381 0.537 . . . . 0.0 111.359 177.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -89.78 -37.51 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.45 ' HG ' HG23 ' A' ' 18' ' ' ILE . 67.9 p -52.06 -51.39 57.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 108.673 174.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 ttt85 -51.55 -53.56 36.68 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 128.133 2.573 . . . . 0.0 111.354 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -68.61 -12.43 61.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.677 0.671 . . . . 0.0 112.789 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 27.6 m-85 -102.57 -7.93 21.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 118.727 0.694 . . . . 0.0 111.041 173.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -87.63 -37.99 16.3 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.406 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 80.1 mt-30 -64.69 -12.57 47.92 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -84.09 -15.46 47.28 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.36 0.664 . . . . 0.0 111.898 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -145.43 41.7 1.25 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.921 0.489 . . . . 0.0 110.969 -173.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 24.9 p80 51.29 37.76 19.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 176.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.406 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 17.0 m95 58.34 45.51 16.82 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.901 1.28 . . . . 0.0 112.066 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -96.65 113.5 25.07 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 175.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.33 -17.5 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.129 -170.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.3 -43.06 13.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -67.06 -40.04 86.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.617 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.65 72.47 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.485 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.9 mt -73.59 -31.32 63.52 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.122 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -75.75 -37.3 59.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -71.09 -40.15 71.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.078 -0.389 . . . . 0.0 110.612 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 37.8 t80 -68.1 -40.85 82.52 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.709 -0.619 . . . . 0.0 111.555 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -71.33 -9.42 58.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.943 0.338 . . . . 0.0 110.17 176.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 CA--C 1.529 0.165 0 C-N-CA 122.448 0.299 . . . . 0.0 111.14 174.946 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.481 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.48 -25.37 70.36 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 123.986 3.124 . . . . 0.0 109.822 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -91.99 -45.88 8.1 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.154 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.481 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.0 mm-40 -69.93 -12.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.793 0.437 . . . . 0.0 111.666 -175.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -79.67 -14.63 58.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.688 177.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.54 -47.61 3.35 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.031 171.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -60.34 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.194 -178.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -73.31 -20.7 60.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 118.381 -1.328 . . . . 0.0 111.099 -175.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -81.55 -33.29 31.81 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -80.37 -58.15 3.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.681 -176.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -58.13 -27.44 63.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.06 0.944 . . . . 0.0 112.488 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 m -83.04 -28.5 29.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.96 0.8 . . . . 0.0 111.347 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.1 tp -83.45 -14.98 51.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.7 0.4 . . . . 0.0 111.723 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.3 p -121.38 -0.66 9.79 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 123.232 0.613 . . . . 0.0 111.545 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.55 11.14 5.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 169.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.1 p -87.77 -172.27 3.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.107 0.563 . . . . 0.0 110.511 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -89.05 145.41 34.36 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -51.79 -25.31 20.57 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.322 2.681 . . . . 0.0 114.483 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -79.96 -17.45 52.94 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.959 0.799 . . . . 0.0 111.536 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.5 t -84.52 -35.41 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.0 t -59.18 -52.2 66.7 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -47.56 -55.9 8.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.975 1.31 . . . . 0.0 110.742 178.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -66.04 -20.38 66.16 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -90.57 -28.16 18.65 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-N 119.466 1.03 . . . . 0.0 109.603 175.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.64 -35.5 75.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -66.76 -15.23 63.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.2 mtm-85 -91.4 -7.52 50.51 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.589 0.356 . . . . 0.0 111.066 178.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -134.02 24.43 3.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.239 0.616 . . . . 0.0 111.227 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 53.52 31.65 12.75 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.373 0.669 . . . . 0.0 111.914 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.6 m95 60.44 34.64 20.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.723 1.209 . . . . 0.0 112.227 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -87.57 110.51 20.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tt -70.22 -16.04 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 119.436 -0.906 . . . . 0.0 111.938 -171.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -85.28 -42.41 14.66 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.67 -39.71 80.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.66 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.85 -26.89 60.81 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.89 -177.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.2 mt -75.04 -34.67 61.89 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -69.98 -32.49 70.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -71.81 -35.29 69.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -77.29 -37.83 51.94 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -63.85 -15.13 58.12 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 118.36 0.527 . . . . 0.0 109.681 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.453 -0.283 0 C-N-CA 122.421 0.288 . . . . 0.0 111.577 175.737 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.446 -0.639 0 CA-C-O 120.981 0.419 . . . . 0.0 110.668 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.9 Cg_exo -67.33 -29.06 38.96 Favored 'Trans proline' 0 N--CA 1.454 -0.829 1 C-N-CA 125.703 4.268 . . . . 0.0 111.673 -174.17 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.443 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 53.7 mt-10 -94.54 -33.33 13.09 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.728 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -74.56 -13.44 60.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 122.773 0.429 . . . . 0.0 111.038 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.71 -14.79 56.1 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -50.37 3.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.769 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.7 mt -58.95 -49.72 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 118.734 -0.65 . . . . 0.0 112.236 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -73.56 -21.12 60.45 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.054 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.74 -33.34 31.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -80.82 -58.43 3.1 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 124.462 1.105 . . . . 0.0 109.643 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -58.23 -27.72 64.21 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.635 -179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -82.1 -28.22 32.42 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.888 0.767 . . . . 0.0 111.464 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 48.0 tp -83.12 -15.68 49.77 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 111.79 177.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.1 p -118.85 -1.54 11.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 122.927 0.491 . . . . 0.0 111.59 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 63.23 11.21 5.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.717 0.407 . . . . 0.0 111.891 169.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -92.98 -173.02 3.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.877 0.871 . . . . 0.0 110.205 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -84.79 143.67 40.96 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 122.939 0.496 . . . . 0.0 110.503 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.53 -26.75 56.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.452 2.768 . . . . 0.0 113.896 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-N 118.149 0.431 . . . . 0.0 110.989 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -87.78 -36.94 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.8 t -58.08 -48.67 79.44 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttt85 -47.99 -55.62 9.61 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.322 1.449 . . . . 0.0 110.642 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -70.27 -13.41 62.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -97.67 -26.12 14.87 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 119.267 0.94 . . . . 0.0 109.269 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.42 -33.14 66.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -68.58 -14.34 62.95 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.053 -0.404 . . . . 0.0 111.707 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -92.87 -7.59 45.81 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 123.149 0.579 . . . . 0.0 111.127 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -134.29 25.56 3.83 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.418 0.687 . . . . 0.0 111.743 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 53.71 30.53 11.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.597 0.759 . . . . 0.0 112.279 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 15.9 m95 59.53 33.77 22.25 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.918 1.287 . . . . 0.0 112.643 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -85.22 116.18 23.43 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.55 -2.018 . . . . 0.0 105.55 172.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -74.18 -16.4 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 118.94 -1.104 . . . . 0.0 111.689 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -84.88 -40.74 16.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.65 -40.34 73.1 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.964 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.49 62.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.1 mt -75.74 -36.16 60.0 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.086 0.403 . . . . 0.0 110.116 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.07 -31.01 68.4 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -70.44 -35.92 73.66 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -76.58 -37.7 56.1 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 121.763 -0.586 . . . . 0.0 111.964 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -63.68 -15.44 58.39 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.0 t70 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 176.299 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.496 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -67.26 -25.5 42.74 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.858 3.039 . . . . 0.0 109.818 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.495 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 33.1 mt-10 -91.67 -47.15 7.54 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.252 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.496 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 13.8 mm-40 -70.56 -11.24 60.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.266 0.354 . . . . 0.0 111.628 -174.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.35 -14.3 58.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.49 -51.52 2.86 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.664 0.603 . . . . 0.0 109.922 172.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.7 mt -55.65 -48.44 77.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.919 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -74.08 -22.5 59.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 118.718 -1.193 . . . . 0.0 110.893 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.49 -29.71 33.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -84.11 -53.7 5.34 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -57.38 -29.19 63.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.854 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 m -81.52 -26.76 34.85 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.725 0.693 . . . . 0.0 112.157 176.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 56.9 tp -90.2 -22.4 21.7 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.397 0.679 . . . . 0.0 112.297 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.7 p -109.06 -4.5 16.57 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 123.007 0.523 . . . . 0.0 111.268 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt 63.64 11.85 6.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 123.455 0.472 . . . . 0.0 111.778 168.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.6 t -97.97 -165.53 1.26 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.628 1.171 . . . . 0.0 110.056 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -84.88 152.23 59.0 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.232 0.613 . . . . 0.0 110.67 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.79 -22.66 31.64 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.403 2.735 . . . . 0.0 111.701 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.66 -16.21 57.59 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 117.862 0.301 . . . . 0.0 110.694 176.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.75 -32.4 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 175.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 52.0 m -60.51 -41.31 94.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 172.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 ttt-85 -66.61 -23.05 66.13 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 125.26 1.424 . . . . 0.0 112.608 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -99.39 -4.95 30.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 120.148 1.34 . . . . 0.0 111.642 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.475 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -107.23 -7.89 16.61 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.1 mt -88.57 -38.27 15.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 171.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.31 -6.75 20.02 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.2 mtp85 -86.57 -14.46 42.81 Favored 'General case' 0 N--CA 1.457 -0.075 0 C-N-CA 122.539 0.335 . . . . 0.0 111.702 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -146.88 37.56 0.97 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.962 0.505 . . . . 0.0 111.709 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 58.08 34.42 24.19 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.495 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.9 m95 58.55 38.33 25.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.427 1.091 . . . . 0.0 112.524 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -88.06 111.77 21.91 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 175.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.1 tt -70.19 -15.15 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 118.944 -1.102 . . . . 0.0 112.265 -169.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.06 -41.39 14.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -178.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -68.59 -42.61 77.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.47 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -34.46 77.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.854 0.862 . . . . 0.0 111.623 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.0 mt -73.24 -33.55 65.37 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.316 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -74.4 -34.12 63.2 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 118.061 0.391 . . . . 0.0 110.213 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.48 -41.16 66.32 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.475 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 53.8 t80 -65.4 -38.59 90.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.702 -0.624 . . . . 0.0 111.325 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -74.42 -10.84 59.97 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.168 -0.332 . . . . 0.0 110.421 174.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 . . . . . 0 N--CA 1.461 0.117 0 CA-C-N 117.652 0.206 . . . . 0.0 110.966 176.906 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.512 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.971 0.415 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.512 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.0 Cg_exo -67.01 -28.57 41.52 Favored 'Trans proline' 0 N--CA 1.454 -0.823 1 C-N-CA 125.331 4.021 . . . . 0.0 112.06 -174.215 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.449 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 68.0 mt-10 -95.37 -34.83 11.99 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.647 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -72.58 -13.31 61.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 123.498 0.499 . . . . 0.0 111.247 -176.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.05 -14.91 55.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -48.98 3.44 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 169.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.1 mt -60.46 -50.94 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.056 -175.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.11 -20.93 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.672 -1.211 . . . . 0.0 111.115 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -84.19 -28.27 27.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 122.026 0.917 . . . . 0.0 108.65 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -85.62 -58.34 2.7 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.174 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -57.06 -26.14 59.86 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.093 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.4 p -79.1 -38.97 34.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 118.934 0.788 . . . . 0.0 111.627 172.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.7 tp -77.28 -12.71 59.98 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.04 0.536 . . . . 0.0 112.094 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.8 p -123.22 -0.59 8.82 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.257 0.623 . . . . 0.0 111.747 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp 62.98 10.91 4.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.4 p -88.17 -171.82 3.54 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.181 0.593 . . . . 0.0 111.084 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -87.32 146.0 38.96 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -55.9 -23.08 40.88 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.365 2.71 . . . . 0.0 113.691 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -84.72 -11.36 55.99 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.969 0.349 . . . . 0.0 111.255 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -87.87 -38.38 11.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.8 t -57.52 -45.38 85.07 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.9 ttt85 -49.31 -58.48 5.01 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.98 1.312 . . . . 0.0 110.353 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -66.25 -14.38 61.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -174.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 24.4 m-85 -100.56 -17.77 16.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.229 0.922 . . . . 0.0 110.028 175.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 mt -78.58 -35.8 45.32 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.402 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 78.8 mt-30 -65.56 -15.43 62.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.731 0.412 . . . . 0.0 111.645 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -87.15 -10.41 52.78 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 123.674 0.789 . . . . 0.0 111.218 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -140.98 33.62 1.75 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 122.734 0.414 . . . . 0.0 111.398 -172.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 p80 49.19 35.09 6.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 20.6 m95 57.32 38.68 28.64 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.245 1.418 . . . . 0.0 112.724 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.57 119.3 31.37 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.044 -1.835 . . . . 0.0 106.044 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -74.44 -18.28 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 119.024 -1.07 . . . . 0.0 111.734 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -84.87 -42.2 15.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -176.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -68.88 -38.86 79.94 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.803 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.03 -26.67 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.428 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -76.35 -33.44 58.96 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 118.025 0.375 . . . . 0.0 110.341 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -72.72 -34.12 66.89 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.147 0.43 . . . . 0.0 109.953 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.82 -40.23 72.58 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.07 -0.394 . . . . 0.0 110.241 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.431 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.1 t80 -66.24 -39.43 89.54 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.689 -0.632 . . . . 0.0 111.245 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -75.81 -6.52 51.1 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 122.219 -0.3 . . . . 0.0 110.674 174.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 CA--C 1.53 0.178 0 CA-C-O 120.609 0.242 . . . . 0.0 110.878 175.316 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.536 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.536 0 CA-C-O 121.071 0.462 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.5 Cg_exo -67.62 -29.87 35.8 Favored 'Trans proline' 0 N--CA 1.453 -0.853 1 C-N-CA 125.519 4.146 . . . . 0.0 111.778 -173.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 31.5 mt-10 -91.96 -32.93 15.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.356 176.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -76.71 -11.8 59.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.018 0.527 . . . . 0.0 111.16 -174.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.47 -13.18 52.75 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.96 -45.39 3.63 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 170.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.2 mt -61.17 -50.33 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -72.63 -20.74 61.22 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.967 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -83.05 -32.99 26.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -80.09 -59.06 2.86 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.247 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -56.92 -27.35 60.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.212 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.1 m -82.29 -27.09 32.55 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.076 0.853 . . . . 0.0 112.076 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.7 tp -88.47 -21.03 24.41 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.198 0.599 . . . . 0.0 111.923 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -110.34 -3.2 16.3 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 123.168 0.587 . . . . 0.0 110.89 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt 63.58 12.94 6.87 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 123.647 0.592 . . . . 0.0 111.72 168.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.8 p -88.89 -165.59 1.38 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.911 0.884 . . . . 0.0 110.427 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.05 146.62 31.62 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -53.29 -18.61 10.94 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.444 2.763 . . . . 0.0 114.257 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -82.77 -13.77 55.68 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.8 0.727 . . . . 0.0 111.846 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -92.05 -36.36 7.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -54.18 -56.58 16.83 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -57.45 -39.28 75.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.803 -174.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -73.74 -14.33 61.11 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.034 0.834 . . . . 0.0 112.787 -178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.405 ' CD2' ' NH2' ' A' ' 38' ' ' ARG . 11.0 m-85 -98.44 -26.11 14.57 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 118.762 0.71 . . . . 0.0 109.857 172.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.28 -33.93 61.29 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -67.35 -12.13 59.42 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.166 0.586 . . . . 0.0 111.511 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.405 ' NH2' ' CD2' ' A' ' 35' ' ' TYR . 33.2 mtm-85 -97.79 -10.39 24.89 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 122.873 0.469 . . . . 0.0 111.463 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -131.03 27.88 4.83 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.368 0.667 . . . . 0.0 110.872 -174.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 53.59 31.7 13.0 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.702 0.801 . . . . 0.0 112.125 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 16.9 m95 58.77 31.53 21.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.347 1.059 . . . . 0.0 112.378 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.53 110.69 18.87 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -70.42 -15.7 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 119.378 -0.929 . . . . 0.0 111.867 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -85.07 -42.29 14.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.74 -39.91 80.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.646 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.8 -26.03 60.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.757 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.9 -34.84 64.55 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -72.98 -27.21 61.67 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -82.63 -12.18 57.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.746 0.419 . . . . 0.0 111.761 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -98.46 -36.15 10.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.76 1.224 . . . . 0.0 110.926 172.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -71.57 -10.09 59.23 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 172.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.922 0.391 . . . . 0.0 110.434 175.279 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.527 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -64.4 -25.58 63.56 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.215 3.277 . . . . 0.0 110.063 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -90.52 -45.34 9.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.388 -1.733 . . . . 0.0 109.914 177.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.527 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.75 -15.63 62.7 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.007 0.523 . . . . 0.0 110.894 -173.138 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.62 -13.53 60.06 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.95 -56.74 2.33 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.077 170.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -51.91 -51.21 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 C-N-CA 123.395 0.678 . . . . 0.0 112.411 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -75.55 -20.32 58.74 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 118.153 -1.419 . . . . 0.0 111.127 -173.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.6 t -80.89 -32.35 34.84 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -80.96 -59.22 2.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.6 1.16 . . . . 0.0 109.307 -174.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.8 t -56.48 -28.61 60.21 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.505 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.2 m -81.93 -26.09 34.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.836 0.744 . . . . 0.0 111.776 175.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.75 -23.3 25.52 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.13 0.572 . . . . 0.0 111.87 178.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.9 p -107.6 -3.98 18.76 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.066 0.546 . . . . 0.0 110.791 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt 63.67 12.27 6.44 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.658 0.383 . . . . 0.0 111.473 169.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -94.44 -167.89 1.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.401 1.08 . . . . 0.0 110.792 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -88.17 142.09 31.53 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.034 0.934 . . . . 0.0 109.423 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -64.98 -17.05 58.34 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.276 2.651 . . . . 0.0 113.187 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 30' ' ' LYS . 11.2 mmpt? -83.22 -9.92 58.87 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.394 0.543 . . . . 0.0 110.329 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -91.86 -35.2 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -57.49 -46.54 83.6 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 76.4 ttt-85 -47.52 -58.45 4.2 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 125.316 1.446 . . . . 0.0 110.052 175.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -68.78 -11.74 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -175.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.465 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 19.5 m-85 -102.77 -17.01 15.78 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.398 0.999 . . . . 0.0 109.714 174.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.9 mt -80.07 -35.69 36.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -65.96 -17.09 64.44 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.761 0.425 . . . . 0.0 111.389 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.3 mtp85 -83.45 -9.52 58.95 Favored 'General case' 0 C--O 1.23 0.042 0 C-N-CA 123.502 0.721 . . . . 0.0 111.062 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -142.01 27.7 1.78 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 54.41 31.34 14.4 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.36 0.664 . . . . 0.0 112.402 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 14.9 m95 60.16 34.5 21.13 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.795 1.238 . . . . 0.0 112.621 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.98 116.91 25.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 172.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -73.29 -17.6 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 118.913 -1.115 . . . . 0.0 111.677 -169.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.59 -42.32 15.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.84 -39.57 79.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.595 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.4 -27.06 62.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.607 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.8 mt -76.08 -33.88 59.53 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.259 0.481 . . . . 0.0 110.508 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -71.66 -35.34 70.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -70.97 -41.38 71.12 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.465 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 59.7 t80 -65.24 -39.1 92.26 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 121.635 -0.666 . . . . 0.0 111.182 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -77.14 -4.95 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.389 -0.195 . . . . 0.0 110.782 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.529 0.168 0 CA-C-N 117.708 0.231 . . . . 0.0 111.001 174.86 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.539 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.936 0.398 . . . . 0.0 110.106 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.5 Cg_exo -67.88 -30.46 33.19 Favored 'Trans proline' 0 N--CA 1.455 -0.785 1 C-N-CA 125.51 4.14 . . . . 0.0 111.166 -175.159 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -88.66 -38.54 14.71 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.477 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 -8.22 57.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -171.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.52 -12.87 53.38 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.88 -49.82 2.85 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.304 170.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.47 HG22 ' HG ' ' A' ' 32' ' ' SER . 11.3 mt -56.07 -52.47 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 CA-C-N 118.648 0.658 . . . . 0.0 112.282 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -74.55 -20.62 59.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 118.387 -1.325 . . . . 0.0 110.803 -172.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 t -80.89 -33.46 34.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -78.25 -63.42 1.4 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.485 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -52.67 -27.65 18.25 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.304 1.041 . . . . 0.0 112.917 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m -84.2 -28.05 27.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.277 0.944 . . . . 0.0 112.039 174.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.82 -18.97 35.82 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.028 0.531 . . . . 0.0 111.473 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.2 p -116.83 -1.87 11.95 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.36 12.33 6.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.542 0.526 . . . . 0.0 112.357 169.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.0 p -86.03 -175.37 5.53 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.956 0.503 . . . . 0.0 110.886 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -83.55 145.82 48.72 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -57.81 -9.29 5.52 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.796 2.997 . . . . 0.0 114.749 -178.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -99.25 -12.71 20.14 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.597 0.635 . . . . 0.0 111.473 177.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -89.47 -38.13 10.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.47 ' HG ' HG22 ' A' ' 18' ' ' ILE . 84.7 p -54.36 -49.5 69.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.083 0.944 . . . . 0.0 108.601 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -53.74 -52.36 60.39 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.982 2.513 . . . . 0.0 111.618 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -67.76 -18.01 64.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.694 0.679 . . . . 0.0 112.456 -177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 22.4 m-85 -95.05 -20.41 19.35 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.041 0.837 . . . . 0.0 110.25 174.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.5 mp -75.36 -39.15 59.59 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -64.45 -18.72 65.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.169 0.588 . . . . 0.0 111.717 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.5 mtp85 -81.12 -9.44 59.81 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.373 0.669 . . . . 0.0 111.174 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -140.52 27.55 2.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.634 0.374 . . . . 0.0 111.839 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 53.9 33.39 17.12 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.549 0.74 . . . . 0.0 112.116 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.7 m95 59.87 31.6 20.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.519 1.128 . . . . 0.0 112.67 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -86.6 112.08 21.25 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tt -69.75 -16.97 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.912 -170.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -85.26 -42.75 14.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -177.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.55 -38.88 81.18 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.6 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.66 -26.94 61.82 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.6 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -74.22 -34.31 63.65 Favored 'General case' 0 C--N 1.338 0.078 0 CA-C-N 118.222 0.465 . . . . 0.0 109.935 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -71.48 -35.79 70.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.154 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -70.93 -42.09 70.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.459 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.3 t80 -66.38 -38.65 88.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.574 -0.704 . . . . 0.0 111.424 177.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -76.78 -5.68 49.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.555 0.161 . . . . 0.0 110.818 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 CA--C 1.529 0.154 0 CA-C-N 117.925 0.33 . . . . 0.0 111.215 175.374 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.275 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -63.52 -25.45 70.06 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.958 3.105 . . . . 0.0 110.009 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.401 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 62.6 mt-10 -90.73 -45.92 8.56 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 113.625 -1.625 . . . . 0.0 109.885 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.531 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.73 -16.19 62.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.171 0.588 . . . . 0.0 110.88 -172.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.42 -14.0 60.09 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.81 -54.55 2.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 123.644 0.59 . . . . 0.0 110.176 171.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 mt -52.78 -53.3 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-O 118.737 -0.649 . . . . 0.0 112.267 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -73.18 -21.26 60.72 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 118.088 -1.445 . . . . 0.0 111.072 -173.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.0 t -81.46 -29.6 33.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -85.34 -56.96 3.27 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.153 0.981 . . . . 0.0 109.542 -174.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -57.06 -27.43 61.69 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.293 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -83.6 -30.33 27.05 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 119.076 0.853 . . . . 0.0 111.533 174.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -81.4 -16.09 53.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.855 0.462 . . . . 0.0 111.325 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -120.11 -1.28 10.37 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.558 0.743 . . . . 0.0 111.705 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp 63.05 10.07 4.23 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.455 0.472 . . . . 0.0 112.242 169.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.5 p -89.33 -172.44 3.62 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.183 0.593 . . . . 0.0 110.925 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -86.94 145.19 37.96 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -55.22 -23.16 35.63 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.387 2.725 . . . . 0.0 113.864 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -83.97 -12.5 55.22 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.026 0.375 . . . . 0.0 111.127 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.7 t -86.48 -38.65 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.5 t -57.71 -47.1 83.32 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 74.1 ttt-85 -53.52 -23.88 11.76 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 125.072 1.349 . . . . 0.0 112.263 177.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -99.94 -11.04 21.0 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 120.419 1.463 . . . . 0.0 112.315 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 40.3 m-85 -102.0 -7.36 22.43 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.082 0.401 . . . . 0.0 109.974 171.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.434 HD21 ' CE3' ' A' ' 41' ' ' TRP . 4.7 mp -86.9 -41.98 13.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 77.0 mt-30 -64.74 -10.43 27.45 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -76.81 -21.85 54.49 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.719 0.808 . . . . 0.0 111.372 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -144.45 35.73 1.19 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.137 0.575 . . . . 0.0 112.399 -171.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 57.55 36.16 26.56 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CE3' HD21 ' A' ' 36' ' ' LEU . 17.0 m95 60.13 46.0 11.09 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.009 0.923 . . . . 0.0 112.602 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -98.68 111.05 23.55 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 175.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 tt -67.06 -17.83 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 120.237 -0.585 . . . . 0.0 112.15 -171.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -86.68 -44.02 12.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.347 -0.845 . . . . 0.0 108.896 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.4 m-30 -66.45 -38.54 87.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.537 177.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.37 -30.74 68.8 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.265 0.626 . . . . 0.0 112.004 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -72.73 -31.54 65.04 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.777 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -74.6 -36.77 62.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.16 -44.37 72.4 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 117.803 0.274 . . . . 0.0 110.609 -179.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.455 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 30.3 t80 -68.85 -36.63 78.37 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.694 -0.629 . . . . 0.0 111.506 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -74.88 -7.92 54.94 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.061 -0.399 . . . . 0.0 110.282 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 122.084 0.154 . . . . 0.0 111.15 174.968 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.533 0.291 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -63.76 -26.53 68.07 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 124.003 3.135 . . . . 0.0 109.917 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.429 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 52.4 mt-10 -89.07 -47.51 8.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.169 -1.832 . . . . 0.0 109.892 177.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.25 -16.27 63.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.753 0.658 . . . . 0.0 111.157 -172.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.9 -12.34 59.94 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.95 -51.64 2.77 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.617 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.428 HG21 ' HG ' ' A' ' 32' ' ' SER . 5.8 mt -54.84 -53.15 35.84 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 118.713 -0.661 . . . . 0.0 111.628 -178.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -73.93 -20.78 60.28 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.203 -172.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -82.3 -28.62 31.6 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -84.15 -63.81 1.28 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.925 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -49.63 -28.23 5.58 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.341 1.057 . . . . 0.0 112.733 177.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.3 p -79.51 -39.55 31.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.27 0.941 . . . . 0.0 111.803 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.0 tp -78.19 -18.74 55.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.471 0.709 . . . . 0.0 111.983 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.0 p -111.13 -3.04 15.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.273 0.629 . . . . 0.0 110.801 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 63.82 11.59 6.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.543 0.527 . . . . 0.0 111.935 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -94.49 -174.44 3.33 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.941 0.497 . . . . 0.0 111.606 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -80.94 151.41 70.48 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.098 0.559 . . . . 0.0 111.055 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.88 -2.18 9.82 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.983 3.122 . . . . 0.0 112.217 -177.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -102.37 -7.8 21.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.2 0.6 . . . . 0.0 111.07 175.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.3 t -102.54 -35.28 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.097 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.428 ' HG ' HG21 ' A' ' 18' ' ' ILE . 82.2 p -51.18 -47.81 62.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 122.656 1.217 . . . . 0.0 108.816 172.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -54.82 -52.32 63.07 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 128.757 2.823 . . . . 0.0 112.058 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.05 -14.35 61.84 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.59 0.632 . . . . 0.0 112.474 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.42 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 32.1 m-85 -98.33 -5.3 33.15 Favored 'General case' 0 C--N 1.337 0.037 0 C-N-CA 123.255 0.622 . . . . 0.0 110.233 172.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.0 mp -93.31 -48.15 6.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 173.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -55.86 -25.1 40.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.956 0.502 . . . . 0.0 110.89 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.286 20.3 ttm180 -65.1 -20.64 66.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.988 2.515 . . . . 0.0 113.64 -178.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -144.56 29.95 1.24 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.975 0.91 . . . . 0.0 110.217 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 61.82 36.6 15.99 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.061 0.545 . . . . 0.0 112.059 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.8 m95 61.05 42.71 12.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.854 1.261 . . . . 0.0 111.884 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -95.35 112.48 24.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.93 -16.71 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.886 -171.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.77 -43.28 12.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -67.12 -39.23 86.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.601 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.4 -31.17 70.33 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.808 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.39 -28.2 60.99 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.906 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.85 -38.4 53.83 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.159 176.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.36 -41.75 66.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.916 -0.49 . . . . 0.0 110.995 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.42 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 43.8 t80 -68.3 -36.66 79.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 121.581 -0.699 . . . . 0.0 111.375 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -74.97 -9.16 58.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.531 0.239 0 CA-C-N 117.61 0.187 . . . . 0.0 111.018 174.645 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.765 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -74.15 -27.37 11.81 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.307 2.672 . . . . 0.0 110.513 172.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.414 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 47.5 mt-10 -89.14 -46.37 8.87 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.837 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.9 OUTLIER -70.46 -13.94 62.33 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 125.022 1.329 . . . . 0.0 110.223 -172.039 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -81.43 -12.31 58.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.19 -50.5 2.9 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.281 169.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.597 ' HA ' ' HG ' ' A' ' 32' ' ' SER . 6.7 mt -56.06 -51.94 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -74.99 -19.64 60.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 118.514 -1.274 . . . . 0.0 110.775 -173.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -82.1 -32.31 30.28 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -81.58 -56.26 4.13 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.783 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -58.27 -28.69 65.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.409 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -82.92 -26.32 31.59 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 118.856 0.753 . . . . 0.0 111.629 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.4 tp -86.49 -18.65 31.08 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.097 0.559 . . . . 0.0 111.686 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -111.28 -4.17 15.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.149 0.58 . . . . 0.0 111.228 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt 63.4 10.35 4.73 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.558 0.536 . . . . 0.0 111.642 169.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 t -95.04 -170.73 2.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.967 0.907 . . . . 0.0 110.569 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.9 t70 -84.71 144.65 42.77 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.149 0.58 . . . . 0.0 110.454 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 69.6 Cg_exo -56.06 -24.45 49.17 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.652 2.901 . . . . 0.0 114.098 -177.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -81.51 -18.8 43.81 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 117.901 0.319 . . . . 0.0 110.481 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -81.99 -34.62 12.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.597 ' HG ' ' HA ' ' A' ' 18' ' ' ILE . 28.1 t -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -47.63 -54.88 10.64 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.541 1.136 . . . . 0.0 110.767 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -66.59 -18.79 65.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -176.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -94.58 -21.75 18.64 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.462 1.028 . . . . 0.0 109.976 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 mp -74.18 -37.2 64.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -66.84 -16.67 64.45 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.124 -0.36 . . . . 0.0 111.801 177.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -84.13 -9.55 58.49 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.183 0.593 . . . . 0.0 110.912 177.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -141.45 26.84 1.93 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.796 0.439 . . . . 0.0 111.706 -171.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 53.62 33.01 15.53 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.605 0.762 . . . . 0.0 112.533 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.414 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 16.2 m95 60.44 33.6 20.63 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.533 1.133 . . . . 0.0 112.379 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -88.82 110.77 21.32 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 172.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.5 tt -69.46 -16.58 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 C-N-CA 119.758 -0.777 . . . . 0.0 112.23 -171.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -85.04 -42.79 14.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.7 -39.74 80.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.815 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.9 -27.66 62.01 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.68 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.1 mt -75.63 -33.59 60.51 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -70.08 -37.46 75.45 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -70.94 -32.14 68.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.298 -0.251 . . . . 0.0 110.713 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -80.6 -35.73 33.73 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.479 -0.763 . . . . 0.0 111.758 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.34 -12.75 45.3 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 175.272 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.55 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -66.67 -25.66 46.66 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 124.21 3.274 . . . . 0.0 110.039 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.469 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 41.4 mt-10 -90.93 -47.35 7.64 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 113.41 -1.723 . . . . 0.0 109.873 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.55 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.12 -14.06 62.48 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.42 0.688 . . . . 0.0 110.828 -173.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.25 -14.61 59.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.77 -56.68 2.33 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.052 170.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.1 mt -52.24 -50.08 38.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -76.16 -20.31 57.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 118.272 -1.371 . . . . 0.0 110.695 -174.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -82.41 -26.97 32.3 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -87.1 -52.7 5.28 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -174.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 t -58.87 -30.15 67.52 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.195 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -84.23 -28.54 27.19 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.834 0.743 . . . . 0.0 111.992 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.4 tt -84.33 -22.57 30.57 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.094 -0.379 . . . . 0.0 111.209 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.3 p -112.59 -3.23 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.298 0.639 . . . . 0.0 111.77 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp 63.89 9.24 4.37 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.481 0.488 . . . . 0.0 112.032 169.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 t -90.19 -168.86 2.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.991 0.916 . . . . 0.0 109.934 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -86.6 144.38 37.44 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 122.893 0.477 . . . . 0.0 110.365 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -56.97 -26.55 68.67 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.445 2.763 . . . . 0.0 113.498 -177.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -79.51 -18.89 50.95 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.15 0.432 . . . . 0.0 110.797 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.0 t -82.81 -33.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.0 m -60.2 -46.77 88.61 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.5 ttt-85 -60.47 -37.54 81.33 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 125.479 1.512 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -86.19 -8.2 57.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 119.519 1.054 . . . . 0.0 113.114 -175.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 14.8 m-85 -99.73 -22.64 15.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 24.7 mt -75.47 -34.85 60.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 50.6 mt-30 -68.33 -11.89 60.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -94.98 -5.56 44.37 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.796 0.438 . . . . 0.0 110.955 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -136.84 27.26 2.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.528 0.731 . . . . 0.0 111.408 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 54.39 31.32 14.32 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.661 0.784 . . . . 0.0 112.35 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.1 m95 58.97 31.85 21.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.532 1.133 . . . . 0.0 112.649 -178.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.93 117.41 23.91 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 173.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tt -73.62 -17.1 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 118.802 -1.159 . . . . 0.0 112.013 -169.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -85.68 -41.89 14.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.83 -40.15 79.62 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.683 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.14 -27.78 62.83 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.541 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.6 mt -75.53 -31.63 60.17 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.361 177.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -72.94 -31.7 64.77 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.069 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -71.94 -34.79 69.31 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.424 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 56.5 t80 -71.65 -44.84 63.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.796 -0.565 . . . . 0.0 111.268 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -64.89 -16.28 63.04 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 117.814 0.279 . . . . 0.0 110.39 176.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.5 t70 . . . . . 0 N--CA 1.455 -0.191 0 C-N-CA 122.636 0.374 . . . . 0.0 110.777 177.562 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.486 ' HB3' ' CG ' ' A' ' 15' ' ' GLN . 1.1 t . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -63.5 -25.98 70.13 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.805 3.004 . . . . 0.0 110.043 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 32.9 mt-10 -91.36 -46.37 8.06 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.796 -1.547 . . . . 0.0 109.773 177.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.486 ' CG ' ' HB3' ' A' ' 12' ' ' SER . 11.6 mm-40 -70.37 -12.5 61.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 123.343 0.402 . . . . 0.0 111.796 -174.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -79.36 -15.18 58.32 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.25 -51.56 2.86 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.794 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.6 mt -56.16 -48.93 78.51 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.948 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -75.67 -21.25 57.81 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.374 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 t -81.3 -34.68 31.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -76.3 -62.33 1.65 Allowed 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.111 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -54.44 -29.66 50.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.867 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -81.2 -25.64 36.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 119.056 0.844 . . . . 0.0 112.073 175.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.6 tp -89.97 -22.53 21.89 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.927 0.491 . . . . 0.0 112.077 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.6 p -109.02 -3.75 17.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.238 0.615 . . . . 0.0 111.056 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt 63.51 13.5 7.25 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.707 0.403 . . . . 0.0 111.854 168.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.7 p -87.38 -169.5 2.64 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.627 0.771 . . . . 0.0 110.65 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -88.15 144.39 34.29 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -59.29 -7.93 5.9 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.995 3.13 . . . . 0.0 114.683 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.535 ' HE2' ' HA ' ' A' ' 30' ' ' LYS . 10.7 mmpt? -97.95 -10.76 23.98 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.657 0.662 . . . . 0.0 111.208 176.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -91.53 -38.72 10.86 Favored 'Isoleucine or valine' 0 C--N 1.337 0.06 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -53.4 -44.03 68.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 122.324 1.059 . . . . 0.0 109.157 174.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 62.8 ttt-85 -63.85 -33.14 75.02 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.101 2.56 . . . . 0.0 112.066 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -88.73 -9.87 50.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 119.224 0.92 . . . . 0.0 112.522 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.414 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 12.2 m-85 -97.58 -24.64 15.46 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.2 -35.56 63.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.2 mt-30 -67.38 -12.81 61.15 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -94.63 -7.6 40.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.981 0.513 . . . . 0.0 111.348 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -133.41 27.18 4.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.291 0.636 . . . . 0.0 111.144 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 53.21 31.16 11.06 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.668 0.787 . . . . 0.0 112.223 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.7 m95 58.43 33.21 22.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.593 1.157 . . . . 0.0 112.275 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.07 116.01 22.65 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.21 -16.96 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.929 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.04 -41.18 16.03 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -69.74 -40.37 76.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.679 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.48 -27.68 62.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 122.703 0.401 . . . . 0.0 111.364 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.68 -34.31 64.83 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -73.11 -30.52 63.7 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -17.52 59.38 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 122.579 0.352 . . . . 0.0 111.759 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.414 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.9 t80 -95.28 -36.17 11.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.477 1.111 . . . . 0.0 111.621 174.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -75.05 -5.13 42.43 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.239 -0.288 . . . . 0.0 110.372 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 CA--C 1.528 0.122 0 C-N-CA 122.677 0.391 . . . . 0.0 111.122 175.252 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.471 0 CA-C-O 121.259 0.552 . . . . 0.0 110.726 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 90.3 Cg_endo -83.43 -21.11 4.53 Favored 'Trans proline' 0 N--CA 1.451 -1.0 1 C-N-CA 125.534 4.156 . . . . 0.0 109.805 -168.142 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.479 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 20.9 mt-10 -98.81 -28.21 13.59 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.312 175.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.582 ' N ' HE21 ' A' ' 15' ' ' GLN . 1.2 mm-40 -79.07 -14.38 59.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -175.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -81.05 -11.18 59.57 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.67 -49.16 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.072 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.42 -47.93 88.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 CA-C-N 118.843 0.747 . . . . 0.0 111.77 -178.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -75.14 -20.3 59.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.827 -175.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -84.41 -28.9 26.59 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -83.66 -54.12 5.16 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.3 t -56.71 -30.37 63.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.424 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.8 m -83.4 -26.95 29.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 0.77 . . . . 0.0 111.811 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.4 tp -87.24 -16.41 35.32 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.0 p -119.95 -1.49 10.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 122.806 0.442 . . . . 0.0 111.721 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.96 10.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 169.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.04 -168.58 2.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.159 0.584 . . . . 0.0 110.355 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.79 143.88 34.2 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.61 -24.06 43.27 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.303 2.669 . . . . 0.0 113.71 -177.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -78.68 -19.25 52.93 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 121.867 -0.52 . . . . 0.0 110.738 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -82.66 -32.67 10.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 175.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.2 m -62.5 -47.35 84.35 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 46.3 ttt85 -57.5 -39.18 75.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 111.948 178.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -81.26 -19.06 43.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 119.527 1.058 . . . . 0.0 113.234 -177.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.63 -24.61 19.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 119.258 0.935 . . . . 0.0 109.861 176.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mp -70.19 -36.8 74.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.7 mt-30 -67.57 -12.61 60.78 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -93.8 -7.06 44.49 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.169 0.588 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -134.47 25.51 3.77 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.252 0.621 . . . . 0.0 111.337 -175.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 54.08 31.62 14.12 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.363 0.665 . . . . 0.0 111.729 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 14.5 m95 59.24 32.84 22.31 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.816 1.246 . . . . 0.0 112.416 -177.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.3 110.76 19.31 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.4 tt -69.45 -16.61 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.031 -170.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.62 -42.57 14.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.13 -39.38 82.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.488 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.83 61.01 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.598 -177.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.1 mt -73.18 -33.35 65.38 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -72.09 -32.91 67.46 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -70.02 -37.68 75.68 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.344 -0.223 . . . . 0.0 110.457 178.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -73.26 -41.04 64.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.845 -0.534 . . . . 0.0 111.657 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.12 -9.48 55.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.093 0.406 . . . . 0.0 110.37 175.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.7 t70 . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 122.838 0.455 . . . . 0.0 110.662 175.292 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.54 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.134 0.492 . . . . 0.0 110.877 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.54 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.9 Cg_exo -66.98 -30.54 39.13 Favored 'Trans proline' 0 N--CA 1.456 -0.716 1 C-N-CA 125.479 4.119 . . . . 0.0 111.898 -173.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.446 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 57.7 mt-10 -92.7 -35.27 13.57 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.349 176.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -75.14 -8.44 56.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.13 0.572 . . . . 0.0 111.399 -175.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.95 -14.68 43.96 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.02 -47.7 3.39 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.768 171.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.6 mt -58.16 -51.81 66.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.706 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -70.8 -23.39 62.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 118.779 -1.168 . . . . 0.0 111.164 -175.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.2 t -81.04 -34.29 32.92 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -79.12 -61.3 2.06 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.403 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -53.75 -28.73 36.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.079 0.951 . . . . 0.0 112.618 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.5 m -83.31 -28.08 29.32 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 119.078 0.854 . . . . 0.0 111.812 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 tp -84.28 -16.7 42.18 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.055 0.542 . . . . 0.0 111.781 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.4 p -118.51 -2.04 11.1 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 122.875 0.47 . . . . 0.0 111.752 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp 63.23 10.4 4.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 169.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -89.17 -174.55 4.47 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.812 0.445 . . . . 0.0 110.745 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -80.92 150.46 69.01 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 122.271 0.228 . . . . 0.0 110.89 178.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.4 -22.55 50.71 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -86.72 -10.08 54.5 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -97.85 -36.34 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.8 p -54.9 -36.97 65.76 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 122.341 1.067 . . . . 0.0 109.411 174.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.4 ttt85 -67.73 -54.16 21.61 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 127.909 2.483 . . . . 0.0 110.942 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -67.29 -10.0 46.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.429 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 28.5 m-85 -105.24 -9.3 17.77 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.65 0.659 . . . . 0.0 110.442 174.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -86.44 -38.77 17.0 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -63.7 -16.26 60.61 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.334 0.654 . . . . 0.0 112.761 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -78.32 -15.86 58.3 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.037 0.535 . . . . 0.0 111.605 -178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -143.67 36.52 1.31 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.746 0.419 . . . . 0.0 111.812 -173.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 57.66 33.34 23.11 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 13.9 m95 60.52 39.74 17.77 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.323 1.049 . . . . 0.0 112.306 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -89.6 111.18 22.05 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 174.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -68.19 -16.59 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.932 -169.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.17 -42.33 13.93 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.71 -41.29 83.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.817 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.83 74.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.748 0.819 . . . . 0.0 111.63 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.07 -33.49 63.69 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.148 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.8 -36.7 65.03 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.058 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.64 -43.52 76.14 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.429 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.8 t80 -64.06 -41.3 97.4 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.954 -0.466 . . . . 0.0 111.27 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -72.06 -4.07 26.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.171 0.189 . . . . 0.0 111.031 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.533 0.294 0 O-C-N 122.401 -0.187 . . . . 0.0 111.343 173.598 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -62.09 -25.72 77.59 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.134 3.222 . . . . 0.0 109.69 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.454 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 44.9 mt-10 -90.15 -43.96 10.1 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.877 177.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -73.24 -15.75 61.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.644 0.59 . . . . 0.0 110.926 -172.037 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -76.47 -13.29 60.11 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.07 -54.56 2.6 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.094 170.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 mt -53.44 -52.26 33.96 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.58 0 CA-C-O 118.854 -0.593 . . . . 0.0 112.181 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -74.07 -21.0 60.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.936 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -80.18 -33.39 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -80.74 -59.51 2.65 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.207 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.8 t -55.62 -28.84 57.51 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.377 1.071 . . . . 0.0 112.323 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 m -82.05 -26.24 33.9 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.2 0.909 . . . . 0.0 111.898 174.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -86.87 -22.69 25.6 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.133 0.573 . . . . 0.0 112.051 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -109.0 -3.52 17.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 123.509 0.724 . . . . 0.0 110.864 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt 64.0 12.34 6.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.421 0.451 . . . . 0.0 112.121 168.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -90.02 -165.23 1.3 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.43 0.692 . . . . 0.0 111.041 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -92.7 145.01 29.54 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.16 0.584 . . . . 0.0 109.628 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.09 -25.59 46.15 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.423 2.749 . . . . 0.0 113.807 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.4 -11.73 59.66 Favored 'General case' 0 C--O 1.228 -0.071 0 CA-C-N 118.147 0.431 . . . . 0.0 111.203 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -90.74 -37.53 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.1 t -58.35 -44.67 88.85 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -48.87 -58.28 5.09 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 125.066 1.346 . . . . 0.0 110.603 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -68.18 -13.4 62.21 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 21.3 m-85 -100.97 -18.03 16.5 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.225 0.921 . . . . 0.0 110.118 175.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.2 mt -79.67 -35.28 39.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -66.05 -17.22 64.55 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.507 0.323 . . . . 0.0 111.461 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 -83.0 -10.18 58.91 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.385 0.674 . . . . 0.0 110.941 177.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -141.28 27.91 1.89 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.7 0.4 . . . . 0.0 111.864 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 54.32 31.25 14.0 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.518 0.727 . . . . 0.0 112.283 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.5 m95 60.09 34.31 21.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.52 1.128 . . . . 0.0 112.827 -178.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -86.91 116.39 24.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -72.74 -17.37 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 118.958 -1.097 . . . . 0.0 111.898 -170.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.79 -42.27 15.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -68.97 -39.76 79.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.63 63.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.432 -177.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 31.0 mt -75.71 -33.78 60.34 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 118.014 0.37 . . . . 0.0 110.191 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -71.79 -35.34 69.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.234 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.28 -42.86 71.55 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.707 0.289 . . . . 0.0 110.35 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.44 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 47.2 t80 -64.43 -38.49 91.21 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.548 -0.72 . . . . 0.0 111.408 177.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -77.57 -5.6 50.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.256 0.222 . . . . 0.0 110.841 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-N 117.777 0.262 . . . . 0.0 111.206 174.837 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.1 mt . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -64.44 121.07 13.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.418 175.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -90.1 29.57 1.21 Allowed 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.486 1.114 . . . . 0.0 111.085 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 52.26 18.78 0.95 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 125.64 1.576 . . . . 0.0 113.581 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -158.57 -38.75 0.06 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 122.53 0.332 . . . . 0.0 111.746 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.88 101.77 1.64 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 122.146 0.974 . . . . 0.0 110.498 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.49 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.9 OUTLIER -50.67 165.53 0.35 Allowed Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 113.69 -1.595 . . . . 0.0 111.495 170.405 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -64.29 -24.92 64.7 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.856 3.037 . . . . 0.0 109.927 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -92.55 -45.75 7.96 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.104 176.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.49 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.4 mm-40 -69.41 -13.49 62.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.727 -175.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.94 -14.47 59.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.73 -49.77 3.11 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 171.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt -58.6 -50.72 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.103 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.69 -20.97 61.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.571 -1.252 . . . . 0.0 111.201 -175.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.1 t -82.51 -32.16 28.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -81.33 -58.18 3.16 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.3 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -58.38 -26.88 63.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.031 0.932 . . . . 0.0 112.567 -179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.9 m -83.03 -28.49 29.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 118.711 0.687 . . . . 0.0 111.562 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.5 tp -83.95 -14.91 49.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.023 0.529 . . . . 0.0 111.757 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 p -121.91 -0.72 9.5 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.299 0.639 . . . . 0.0 111.927 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp 63.45 11.77 5.83 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 169.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.3 p -86.99 -172.57 4.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.979 0.512 . . . . 0.0 110.652 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -86.15 145.58 40.81 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -54.6 -23.81 34.02 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.309 2.673 . . . . 0.0 113.845 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -83.85 -12.12 56.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.494 0.318 . . . . 0.0 111.277 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.04 -39.04 13.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.0 t -57.81 -44.68 86.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 174.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -55.66 -23.88 30.67 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.912 1.285 . . . . 0.0 112.091 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -102.5 -6.51 22.81 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 120.052 1.296 . . . . 0.0 112.679 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.429 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -103.06 -16.22 15.84 Favored 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.8 mt -80.21 -39.58 28.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -68.0 -11.85 59.66 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -87.49 -12.78 44.96 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.631 0.372 . . . . 0.0 111.127 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -141.23 36.29 1.71 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.832 0.453 . . . . 0.0 111.37 -171.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 47.75 42.33 15.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 112.327 176.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 26.6 m95 50.86 35.77 13.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.524 1.53 . . . . 0.0 112.925 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -91.65 118.17 30.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tt -73.84 -18.16 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.805 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -84.75 -41.77 15.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -70.67 -36.94 73.58 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.81 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -26.83 61.36 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.523 0.329 . . . . 0.0 111.364 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.4 mt -76.63 -34.75 58.31 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 117.967 0.349 . . . . 0.0 110.392 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.04 -34.37 71.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.597 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.1 t70 -70.87 -40.38 72.31 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 122.2 -0.313 . . . . 0.0 110.274 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.429 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 28.2 t80 -68.95 -37.63 78.94 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.554 -0.716 . . . . 0.0 111.02 177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -73.19 -8.98 58.16 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 122.288 -0.257 . . . . 0.0 110.35 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -92.33 -11.94 33.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.24 0.216 . . . . 0.0 111.063 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.597 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -111.74 -38.83 4.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.126 0.57 . . . . 0.0 111.963 -175.818 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -105.56 -37.79 6.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 122.985 0.514 . . . . 0.0 111.85 -172.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -96.06 -15.37 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.021 0.528 . . . . 0.0 110.954 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.47 8.41 26.72 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.741 0.686 . . . . 0.0 113.239 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.7 t -128.23 26.7 5.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.788 0.794 . . . . 0.0 111.405 -177.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.4 ' C ' ' H ' ' A' ' 60' ' ' ASP . 23.9 p90 -66.88 -24.57 66.13 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -176.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 74.2 p -74.37 32.44 0.09 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -175.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 58' ' ' PHE . 32.2 t70 -85.42 -0.2 54.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.891 0.853 . . . . 0.0 111.51 -178.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -131.13 24.63 4.91 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.067 1.347 . . . . 0.0 111.006 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.1 t . . . . . 0 C--O 1.253 1.257 0 CA-C-O 117.097 -1.43 . . . . 0.0 110.104 -177.01 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.1 mm . . . . . 0 C--O 1.232 0.16 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -84.08 133.25 34.65 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.199 0.523 . . . . 0.0 110.26 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.85 57.35 1.81 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.744 1.217 . . . . 0.0 111.022 -174.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -72.39 45.15 0.13 Allowed 'General case' 0 C--N 1.335 -0.04 0 C-N-CA 126.204 1.802 . . . . 0.0 112.855 -174.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -143.5 -38.96 0.32 Allowed 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.765 0.426 . . . . 0.0 110.361 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -171.5 77.99 0.06 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 122.003 0.906 . . . . 0.0 109.685 177.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -60.58 -178.82 0.17 Allowed Pre-proline 0 N--CA 1.447 -0.578 0 C-N-CA 125.337 1.455 . . . . 0.0 110.195 171.131 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.8 Cg_exo -68.01 -28.89 34.73 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.338 4.025 . . . . 0.0 111.924 -174.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.439 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 30.6 mt-10 -93.29 -32.98 14.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.457 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.81 -15.8 61.17 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.157 0.583 . . . . 0.0 111.034 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -80.25 -13.67 59.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -107.5 -49.1 3.31 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.653 169.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.9 mt -60.21 -49.55 83.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.169 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -72.98 -21.14 60.89 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.123 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -81.87 -33.31 30.63 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -80.48 -59.29 2.75 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.707 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -56.26 -29.1 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.436 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -82.01 -28.26 32.65 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.113 0.87 . . . . 0.0 111.819 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.9 tp -83.65 -17.54 41.15 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.741 0.416 . . . . 0.0 111.92 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.3 p -121.23 -0.33 9.94 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 122.999 0.519 . . . . 0.0 111.675 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.1 11.75 5.47 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 169.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.4 p -86.73 -169.7 2.75 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.222 0.609 . . . . 0.0 111.098 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -88.87 145.14 34.12 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -54.07 -24.2 31.88 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.529 2.82 . . . . 0.0 114.136 -177.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 -16.97 45.78 Favored 'General case' 0 CA--C 1.522 -0.133 0 O-C-N 121.998 -0.439 . . . . 0.0 110.933 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.7 t -81.73 -35.63 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.0 t -60.52 -48.85 79.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -49.39 -57.75 6.37 Favored 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 124.727 1.211 . . . . 0.0 110.214 176.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -65.79 -13.95 60.45 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 16.0 m-85 -102.19 -18.61 15.44 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.459 1.027 . . . . 0.0 109.981 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 34.0 mt -76.63 -34.95 58.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -67.14 -15.96 64.03 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.848 0.459 . . . . 0.0 111.719 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.2 mtp85 -87.86 -10.49 50.6 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.772 0.829 . . . . 0.0 111.094 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -141.03 34.47 1.74 Allowed 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.874 0.47 . . . . 0.0 111.374 -172.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 46.95 40.25 8.97 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.484 0.714 . . . . 0.0 112.183 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.439 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 23.4 m95 52.1 36.77 19.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 125.541 1.536 . . . . 0.0 113.153 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -92.15 120.25 32.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 172.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tt -74.61 -18.44 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 119.058 -1.057 . . . . 0.0 111.603 -170.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -84.4 -42.12 16.0 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -69.9 -37.94 76.16 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.915 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.52 -25.78 60.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 122.612 0.365 . . . . 0.0 111.386 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.9 mt -77.32 -33.41 55.56 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 118.009 0.368 . . . . 0.0 110.292 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -72.22 -34.65 68.5 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 122.033 -0.417 . . . . 0.0 110.06 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.591 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.6 t70 -70.14 -38.0 75.39 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 178.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 54.8 t80 -69.52 -41.81 75.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 121.72 -0.612 . . . . 0.0 111.491 177.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -69.54 -11.24 60.67 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 117.891 0.314 . . . . 0.0 110.328 176.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -89.9 -7.76 53.44 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.551 0.34 . . . . 0.0 110.865 175.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.591 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -115.53 -10.9 11.84 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -171.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -66.74 -20.3 65.93 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.532 0.606 . . . . 0.0 111.652 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.2 mm -74.16 -19.52 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 122.773 0.429 . . . . 0.0 110.463 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.55 -3.79 90.54 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 112.186 -0.365 . . . . 0.0 112.186 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.65 25.64 1.46 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.69 0.757 . . . . 0.0 110.422 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -78.99 -38.46 36.75 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.07 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.1 p -109.36 22.75 15.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.649 0.78 . . . . 0.0 110.033 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -106.35 2.79 26.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.742 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -103.49 13.7 32.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.991 1.316 . . . . 0.0 111.578 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 C--O 1.248 0.977 0 CA-C-O 117.134 -1.412 . . . . 0.0 110.695 -178.724 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.1 mm . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -63.76 120.92 12.78 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 171.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -80.79 35.82 0.37 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.687 1.195 . . . . 0.0 112.311 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -146.03 25.44 1.27 Allowed 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 -171.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -124.12 -16.76 6.4 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 53.15 60.13 3.96 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 122.249 1.023 . . . . 0.0 111.298 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.523 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -52.23 -179.23 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 126.193 1.797 . . . . 0.0 110.764 169.321 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.4 Cg_exo -66.48 -28.78 45.58 Favored 'Trans proline' 0 N--CA 1.456 -0.693 1 C-N-CA 125.632 4.221 . . . . 0.0 112.015 -173.34 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.461 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 59.2 mt-10 -95.2 -31.36 13.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.735 176.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -76.69 -12.22 59.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 123.497 0.498 . . . . 0.0 110.791 -175.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -82.52 -14.65 54.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.74 -49.25 3.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.977 169.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -60.31 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.88 -176.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.44 -20.59 61.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.049 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 t -83.35 -30.38 27.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -83.3 -59.19 2.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.377 1.071 . . . . 0.0 109.75 -176.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.8 t -56.11 -28.79 59.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.547 178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.8 m -83.31 -29.63 28.17 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 119.244 0.929 . . . . 0.0 112.018 175.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -81.24 -16.56 52.31 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.587 0.355 . . . . 0.0 111.108 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -120.62 -1.95 9.99 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.148 0.579 . . . . 0.0 112.016 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp 62.81 10.36 4.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.0 p -89.98 -164.02 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.72 0.808 . . . . 0.0 111.503 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -91.11 144.92 30.66 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.733 0.813 . . . . 0.0 110.427 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.58 -22.27 27.63 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.137 2.558 . . . . 0.0 113.669 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -77.95 -31.35 50.84 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.7 p -83.75 -25.43 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.139 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.3 t -61.82 -51.27 68.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.3 ttt85 -51.4 -58.78 5.3 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 125.386 1.475 . . . . 0.0 110.585 177.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -63.06 -17.84 62.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -176.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.435 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 11.7 m-85 -100.42 -18.11 16.88 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.373 0.988 . . . . 0.0 110.245 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.4 mt -75.25 -34.81 61.43 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 172.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -67.55 -14.69 63.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.858 0.463 . . . . 0.0 111.55 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -90.18 -9.65 47.39 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 124.036 0.935 . . . . 0.0 111.355 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -140.28 33.74 1.89 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.909 0.484 . . . . 0.0 111.362 -172.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.8 p80 49.01 35.54 7.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.347 1.059 . . . . 0.0 112.489 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 21.0 m95 56.06 38.26 29.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.681 1.593 . . . . 0.0 112.416 -178.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -88.99 120.12 30.12 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 171.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -75.14 -17.83 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 118.757 -1.177 . . . . 0.0 111.775 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.11 -41.0 16.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -176.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.7 -38.41 73.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.024 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.67 -26.54 61.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.487 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.1 mt -76.63 -35.07 58.25 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.01 0.368 . . . . 0.0 110.162 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.6 -36.3 70.79 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.581 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 36.0 t70 -69.4 -40.67 77.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.435 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 64.3 t80 -68.83 -41.22 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.767 -0.583 . . . . 0.0 111.274 177.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -69.53 -8.32 46.11 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 117.651 0.205 . . . . 0.0 110.641 175.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -93.46 -6.64 46.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.179 0.192 . . . . 0.0 110.943 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.581 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -119.58 -33.51 4.03 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.348 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -77.76 -12.68 60.0 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.1 mm -65.09 -20.18 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 172.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.78 -5.01 86.2 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 123.155 0.407 . . . . 0.0 112.598 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.4 t -141.27 27.17 1.94 Allowed 'General case' 0 CA--C 1.528 0.116 0 CA-C-O 122.013 0.911 . . . . 0.0 110.156 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.447 ' C ' ' H ' ' A' ' 60' ' ' ASP . 11.0 t80 -77.57 -27.63 51.49 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.505 -175.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 75.6 p -81.97 24.77 0.61 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.323 0.582 . . . . 0.0 110.937 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.447 ' H ' ' C ' ' A' ' 58' ' ' PHE . 27.6 t70 -114.43 4.89 15.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.729 177.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -95.76 12.81 28.66 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.561 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 C--O 1.252 1.205 0 C-N-CA 124.952 1.301 . . . . 0.0 110.449 -178.747 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.6 mt . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 121.906 0.86 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.486 ' C ' ' H ' ' A' ' 9' ' ' LYS . 75.3 mmtt -106.79 50.41 0.77 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.903 1.281 . . . . 0.0 109.999 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -71.58 24.99 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.296 1.438 . . . . 0.0 113.263 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' A' ' 7' ' ' LYS . 53.5 mtmt 42.22 49.79 4.43 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.677 1.191 . . . . 0.0 111.892 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -113.98 -21.03 10.79 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.648 0.261 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 54.78 66.55 1.2 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.246 1.018 . . . . 0.0 110.554 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.506 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -52.58 179.24 0.05 OUTLIER Pre-proline 0 N--CA 1.449 -0.522 0 C-N-CA 126.701 2.0 . . . . 0.0 111.213 173.605 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.4 Cg_exo -67.43 -28.6 38.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.329 4.02 . . . . 0.0 111.602 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.451 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 29.3 mt-10 -92.84 -32.31 14.67 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.381 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -76.63 -13.65 60.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.752 0.421 . . . . 0.0 111.186 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -82.55 -12.34 57.82 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.17 -50.12 3.04 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 28.9 mt -57.82 -48.79 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 CA-C-O 118.736 -0.649 . . . . 0.0 112.295 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -74.08 -20.94 60.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.111 -175.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -82.83 -31.52 28.03 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -82.63 -56.29 3.94 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.27 -175.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -58.44 -28.05 64.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.144 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 m -81.34 -27.96 34.7 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.992 0.815 . . . . 0.0 111.983 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.5 tp -86.66 -20.01 28.42 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.071 0.548 . . . . 0.0 111.877 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.9 p -110.05 -4.03 16.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 123.319 0.648 . . . . 0.0 111.302 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.1 mmtt 63.03 11.56 5.25 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.509 0.505 . . . . 0.0 111.649 169.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.0 t -93.15 -164.31 1.16 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.222 1.009 . . . . 0.0 109.926 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -96.84 145.53 29.74 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 122.92 0.488 . . . . 0.0 110.303 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -54.06 -17.83 12.09 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.592 2.862 . . . . 0.0 114.509 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -83.66 -10.09 58.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.893 0.77 . . . . 0.0 111.844 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -96.94 -36.48 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.8 t -52.62 -52.17 56.68 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.463 0.649 . . . . 0.0 109.763 177.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -59.89 -36.42 76.91 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.676 -176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -77.19 -11.56 59.83 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 119.373 0.988 . . . . 0.0 112.724 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.626 ' HH ' ' HG2' ' A' ' 53' ' ' LYS . 17.3 m-85 -102.32 -20.51 14.58 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 118.967 0.803 . . . . 0.0 109.682 172.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -76.23 -37.13 58.09 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -68.49 -12.99 62.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.237 0.615 . . . . 0.0 111.324 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -90.07 -10.55 44.34 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 123.695 0.798 . . . . 0.0 111.388 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -140.17 30.38 1.99 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.814 0.445 . . . . 0.0 111.593 -171.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 53.56 32.12 13.71 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 123.705 0.802 . . . . 0.0 112.584 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.451 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 18.8 m95 58.9 31.93 21.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.723 1.209 . . . . 0.0 112.776 -178.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -84.6 114.01 21.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 172.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -71.87 -16.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 C-N-CA 118.744 -1.182 . . . . 0.0 111.636 -169.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -84.85 -42.71 14.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -68.26 -40.39 81.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.662 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.89 63.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.567 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.85 -34.7 62.33 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.058 0.39 . . . . 0.0 110.273 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -72.29 -29.45 63.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -78.51 -17.54 56.08 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.122 0.569 . . . . 0.0 111.194 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 40.3 t80 -92.59 -37.87 12.21 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.668 1.187 . . . . 0.0 111.006 172.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -66.93 -14.42 62.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -78.82 -14.7 59.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.902 0.382 . . . . 0.0 111.19 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.626 ' HG2' ' HH ' ' A' ' 35' ' ' TYR . 7.9 mptt -100.88 -28.08 12.97 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.774 0.829 . . . . 0.0 109.908 178.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.19 -35.62 41.5 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 124.165 0.986 . . . . 0.0 110.747 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.1 mm -98.36 -25.22 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 122.927 0.491 . . . . 0.0 110.43 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.79 -5.62 30.2 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-O 119.387 -0.674 . . . . 0.0 114.169 175.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.8 t -149.23 33.39 0.73 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.285 1.042 . . . . 0.0 111.587 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -84.13 -46.41 11.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -172.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.3 t -152.66 29.04 0.54 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 122.192 0.996 . . . . 0.0 109.885 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -67.44 -0.65 3.88 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.044 -0.98 . . . . 0.0 113.327 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -88.28 13.89 10.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.989 1.316 . . . . 0.0 112.014 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--O 1.25 1.089 0 C-N-CA 125.027 1.331 . . . . 0.0 110.049 -179.365 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 122.221 1.01 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.465 ' C ' ' H ' ' A' ' 9' ' ' LYS . 75.5 mmtt -105.88 51.26 0.76 Allowed 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.636 1.574 . . . . 0.0 109.355 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.84 28.86 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.899 1.679 . . . . 0.0 113.517 -176.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.465 ' H ' ' C ' ' A' ' 7' ' ' LYS . 63.3 mttp 44.96 45.04 8.51 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 124.802 1.241 . . . . 0.0 111.814 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -108.2 -15.19 14.55 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 123.231 0.612 . . . . 0.0 111.314 -175.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 43.9 76.8 0.08 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.268 1.427 . . . . 0.0 111.845 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.476 ' HB3' ' CG ' ' A' ' 15' ' ' GLN . 1.3 t -38.65 163.44 0.05 OUTLIER Pre-proline 0 CA--C 1.528 0.114 0 C-N-CA 127.194 2.198 . . . . 0.0 113.643 171.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -62.31 -25.22 76.4 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.825 3.017 . . . . 0.0 109.899 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -91.54 -45.41 8.52 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 113.849 -1.523 . . . . 0.0 109.821 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.476 ' CG ' ' HB3' ' A' ' 12' ' ' SER . 9.9 mm-40 -70.22 -12.87 61.89 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.827 0.451 . . . . 0.0 111.507 -174.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -80.58 -13.24 59.23 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.717 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.11 -46.83 3.17 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 171.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.45 HG23 ' HG ' ' A' ' 32' ' ' SER . 7.4 mt -58.35 -51.97 64.79 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 118.898 -0.572 . . . . 0.0 111.377 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -72.11 -22.27 61.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.131 -174.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 t -81.37 -33.38 32.39 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -78.65 -61.66 1.94 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.552 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -54.15 -27.26 32.4 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 112.898 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.2 m -84.24 -28.35 27.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 118.947 0.794 . . . . 0.0 111.564 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.0 tp -83.84 -16.58 43.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.742 0.417 . . . . 0.0 111.685 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 p -118.7 -1.62 11.08 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.314 0.645 . . . . 0.0 111.607 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp 63.24 12.42 6.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.353 0.408 . . . . 0.0 112.036 169.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.45 -177.36 6.17 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 122.985 0.514 . . . . 0.0 111.104 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -80.93 146.52 59.58 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -58.31 -7.91 4.49 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.985 3.123 . . . . 0.0 114.756 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -101.64 -11.2 19.38 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 118.381 0.537 . . . . 0.0 111.359 177.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -89.78 -37.51 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.45 ' HG ' HG23 ' A' ' 18' ' ' ILE . 67.9 p -52.06 -51.39 57.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 108.673 174.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 ttt85 -51.55 -53.56 36.68 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 128.133 2.573 . . . . 0.0 111.354 178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -68.61 -12.43 61.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.677 0.671 . . . . 0.0 112.789 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 27.6 m-85 -102.57 -7.93 21.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 118.727 0.694 . . . . 0.0 111.041 173.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -87.63 -37.99 16.3 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.406 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 80.1 mt-30 -64.69 -12.57 47.92 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -84.09 -15.46 47.28 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.36 0.664 . . . . 0.0 111.898 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -145.43 41.7 1.25 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.921 0.489 . . . . 0.0 110.969 -173.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 24.9 p80 51.29 37.76 19.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 176.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.406 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 17.0 m95 58.34 45.51 16.82 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.901 1.28 . . . . 0.0 112.066 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -96.65 113.5 25.07 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 175.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.33 -17.5 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.129 -170.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.3 -43.06 13.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -67.06 -40.04 86.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.617 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.65 72.47 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.485 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.9 mt -73.59 -31.32 63.52 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.122 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -75.75 -37.3 59.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.584 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 25.0 t70 -71.09 -40.15 71.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.078 -0.389 . . . . 0.0 110.612 -178.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 37.8 t80 -68.1 -40.85 82.52 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.709 -0.619 . . . . 0.0 111.555 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -71.33 -9.42 58.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.943 0.338 . . . . 0.0 110.17 176.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -91.65 -7.05 51.05 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.448 0.299 . . . . 0.0 111.14 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.584 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -116.82 -6.32 11.52 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -172.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.21 -12.82 55.34 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.277 0.489 . . . . 0.0 111.676 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.6 mm -70.86 -17.87 20.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 122.959 0.504 . . . . 0.0 109.831 178.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -79.17 -4.78 89.05 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 123.41 0.529 . . . . 0.0 112.363 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.2 t -138.83 27.54 2.43 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 121.886 0.85 . . . . 0.0 110.307 178.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.492 ' C ' ' H ' ' A' ' 60' ' ' ASP . 12.1 t80 -78.13 -25.66 47.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.79 0.836 . . . . 0.0 111.741 -175.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 68.7 p -79.82 25.04 0.37 Allowed 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.471 0.653 . . . . 0.0 111.133 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.492 ' H ' ' C ' ' A' ' 58' ' ' PHE . 27.6 t70 -111.15 3.06 18.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.956 177.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -94.99 13.27 25.59 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.509 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.252 1.201 0 C-N-CA 124.774 1.23 . . . . 0.0 110.421 -178.615 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.4 mt . . . . . 0 CA--C 1.533 0.311 0 CA-C-O 121.39 0.614 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.487 ' C ' ' H ' ' A' ' 9' ' ' LYS . 35.3 mmtp -98.59 46.11 1.0 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.946 0.898 . . . . 0.0 110.46 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -73.51 28.61 0.07 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.995 1.318 . . . . 0.0 112.249 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.487 ' H ' ' C ' ' A' ' 7' ' ' LYS . 95.7 mttt 45.82 37.56 3.6 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 125.16 1.384 . . . . 0.0 112.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.18 -40.88 0.17 Allowed 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.88 98.59 1.49 Allowed 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 121.958 0.885 . . . . 0.0 110.837 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.481 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -50.46 165.19 0.35 Allowed Pre-proline 0 C--N 1.332 -0.185 0 C-N-CA 125.866 1.666 . . . . 0.0 112.162 173.018 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.48 -25.37 70.36 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 123.986 3.124 . . . . 0.0 109.822 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -91.99 -45.88 8.1 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.154 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.481 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.0 mm-40 -69.93 -12.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.793 0.437 . . . . 0.0 111.666 -175.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -79.67 -14.63 58.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.688 177.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.54 -47.61 3.35 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.031 171.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -60.34 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.194 -178.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -73.31 -20.7 60.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 118.381 -1.328 . . . . 0.0 111.099 -175.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -81.55 -33.29 31.81 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -80.37 -58.15 3.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.681 -176.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -58.13 -27.44 63.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.06 0.944 . . . . 0.0 112.488 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 m -83.04 -28.5 29.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.96 0.8 . . . . 0.0 111.347 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.1 tp -83.45 -14.98 51.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.7 0.4 . . . . 0.0 111.723 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.3 p -121.38 -0.66 9.79 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 123.232 0.613 . . . . 0.0 111.545 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.55 11.14 5.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 169.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.1 p -87.77 -172.27 3.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.107 0.563 . . . . 0.0 110.511 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -89.05 145.41 34.36 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 177.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -51.79 -25.31 20.57 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.322 2.681 . . . . 0.0 114.483 -178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -79.96 -17.45 52.94 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.959 0.799 . . . . 0.0 111.536 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.5 t -84.52 -35.41 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.0 t -59.18 -52.2 66.7 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -47.56 -55.9 8.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.975 1.31 . . . . 0.0 110.742 178.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -66.04 -20.38 66.16 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -90.57 -28.16 18.65 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-N 119.466 1.03 . . . . 0.0 109.603 175.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.64 -35.5 75.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -66.76 -15.23 63.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.2 mtm-85 -91.4 -7.52 50.51 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.589 0.356 . . . . 0.0 111.066 178.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -134.02 24.43 3.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.239 0.616 . . . . 0.0 111.227 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 53.52 31.65 12.75 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.373 0.669 . . . . 0.0 111.914 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.6 m95 60.44 34.64 20.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.723 1.209 . . . . 0.0 112.227 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -87.57 110.51 20.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tt -70.22 -16.04 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 119.436 -0.906 . . . . 0.0 111.938 -171.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -85.28 -42.41 14.66 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.67 -39.71 80.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.66 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.85 -26.89 60.81 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.89 -177.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.2 mt -75.04 -34.67 61.89 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -69.98 -32.49 70.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.402 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 25.9 t0 -71.81 -35.29 69.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -77.29 -37.83 51.94 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -63.85 -15.13 58.12 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 118.36 0.527 . . . . 0.0 109.681 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.411 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 34.8 t70 -86.34 -14.79 42.5 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.421 0.288 . . . . 0.0 111.577 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.564 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -94.17 -26.11 16.82 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.939 0.496 . . . . 0.0 110.313 -176.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -68.41 -18.71 64.51 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 42.0 mm -89.26 -17.24 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 122.838 0.455 . . . . 0.0 110.581 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.24 20.33 71.15 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 119.876 -0.402 . . . . 0.0 112.942 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -112.07 21.74 15.56 Favored 'General case' 0 CA--C 1.527 0.071 0 CA-C-N 117.676 0.738 . . . . 0.0 112.276 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -41.93 82.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.063 -172.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 33.1 p -86.84 31.74 0.69 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -121.46 4.76 10.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.838 0.828 . . . . 0.0 110.434 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -101.93 13.28 35.23 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.188 -1.369 . . . . 0.0 111.552 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.2 t . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.846 1.258 . . . . 0.0 109.677 -177.854 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -62.45 128.96 38.5 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.649 0.78 . . . . 0.0 109.054 174.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -100.32 19.64 16.25 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.365 0.666 . . . . 0.0 112.302 -177.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 45.23 34.34 1.41 Allowed 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.519 1.527 . . . . 0.0 113.2 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -152.82 -36.29 0.11 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 122.198 0.199 . . . . 0.0 111.137 -176.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -168.31 81.66 0.16 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 122.175 0.988 . . . . 0.0 108.468 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -59.28 -179.32 0.15 Allowed Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.06 1.744 . . . . 0.0 110.668 175.623 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.9 Cg_exo -67.33 -29.06 38.96 Favored 'Trans proline' 0 N--CA 1.454 -0.829 1 C-N-CA 125.703 4.268 . . . . 0.0 111.673 -174.17 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.443 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 53.7 mt-10 -94.54 -33.33 13.09 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.728 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -74.56 -13.44 60.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 122.773 0.429 . . . . 0.0 111.038 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.71 -14.79 56.1 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -50.37 3.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.769 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.7 mt -58.95 -49.72 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 118.734 -0.65 . . . . 0.0 112.236 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -73.56 -21.12 60.45 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.054 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.74 -33.34 31.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -80.82 -58.43 3.1 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 124.462 1.105 . . . . 0.0 109.643 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -58.23 -27.72 64.21 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.635 -179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -82.1 -28.22 32.42 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.888 0.767 . . . . 0.0 111.464 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 48.0 tp -83.12 -15.68 49.77 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 111.79 177.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.1 p -118.85 -1.54 11.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 122.927 0.491 . . . . 0.0 111.59 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 63.23 11.21 5.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.717 0.407 . . . . 0.0 111.891 169.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -92.98 -173.02 3.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.877 0.871 . . . . 0.0 110.205 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -84.79 143.67 40.96 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 122.939 0.496 . . . . 0.0 110.503 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.53 -26.75 56.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.452 2.768 . . . . 0.0 113.896 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-N 118.149 0.431 . . . . 0.0 110.989 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -87.78 -36.94 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.8 t -58.08 -48.67 79.44 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttt85 -47.99 -55.62 9.61 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.322 1.449 . . . . 0.0 110.642 176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -70.27 -13.41 62.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -97.67 -26.12 14.87 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 119.267 0.94 . . . . 0.0 109.269 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.42 -33.14 66.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -68.58 -14.34 62.95 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.053 -0.404 . . . . 0.0 111.707 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -92.87 -7.59 45.81 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 123.149 0.579 . . . . 0.0 111.127 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -134.29 25.56 3.83 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.418 0.687 . . . . 0.0 111.743 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 53.71 30.53 11.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.597 0.759 . . . . 0.0 112.279 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 15.9 m95 59.53 33.77 22.25 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.918 1.287 . . . . 0.0 112.643 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -85.22 116.18 23.43 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.55 -2.018 . . . . 0.0 105.55 172.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -74.18 -16.4 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 118.94 -1.104 . . . . 0.0 111.689 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -84.88 -40.74 16.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.65 -40.34 73.1 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.964 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.49 62.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.1 mt -75.74 -36.16 60.0 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.086 0.403 . . . . 0.0 110.116 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.07 -31.01 68.4 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -70.44 -35.92 73.66 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -76.58 -37.7 56.1 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 121.763 -0.586 . . . . 0.0 111.964 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -63.68 -15.44 58.39 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.402 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 36.0 t70 -86.65 -15.43 39.67 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 176.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.578 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -92.47 -24.71 18.72 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 123.022 0.529 . . . . 0.0 110.327 -176.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -67.29 -12.34 59.89 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.508 0.323 . . . . 0.0 111.835 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.4 mm -83.71 -11.83 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 123.45 0.7 . . . . 0.0 110.375 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -68.81 2.75 7.53 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.031 0.824 . . . . 0.0 113.893 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -98.76 23.02 9.26 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 117.813 0.807 . . . . 0.0 111.743 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.451 ' C ' ' H ' ' A' ' 60' ' ' ASP . 30.3 p90 -69.94 -23.94 63.28 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.28 0.632 . . . . 0.0 112.421 -177.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 77.9 p -75.36 29.11 0.1 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.451 ' H ' ' C ' ' A' ' 58' ' ' PHE . 27.8 t70 -115.18 2.57 14.13 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.968 0.907 . . . . 0.0 110.807 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -100.9 12.2 38.09 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 114.314 -1.312 . . . . 0.0 111.373 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.789 1.636 . . . . 0.0 111.017 -177.919 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 62.8 mt . . . . . 0 C--O 1.232 0.172 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.433 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 6.3 mmpt? -75.56 131.6 40.14 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.7 mmt-85 -80.44 28.16 0.33 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.318 1.047 . . . . 0.0 112.315 -177.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' A' ' 7' ' ' LYS . 90.3 mttt -145.76 12.07 1.28 Allowed 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.249 1.02 . . . . 0.0 110.833 -175.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -156.41 -30.27 0.09 Allowed 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.067 0.547 . . . . 0.0 111.634 -177.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 53.63 -128.08 2.36 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 122.656 1.217 . . . . 0.0 109.018 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.496 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -166.22 165.66 10.14 Favored Pre-proline 0 C--N 1.314 -0.952 0 CA-C-N 112.416 -2.174 . . . . 0.0 110.292 -174.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -67.26 -25.5 42.74 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.858 3.039 . . . . 0.0 109.818 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.495 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 33.1 mt-10 -91.67 -47.15 7.54 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.252 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.496 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 13.8 mm-40 -70.56 -11.24 60.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.266 0.354 . . . . 0.0 111.628 -174.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.35 -14.3 58.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.49 -51.52 2.86 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.664 0.603 . . . . 0.0 109.922 172.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.7 mt -55.65 -48.44 77.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.919 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -74.08 -22.5 59.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 118.718 -1.193 . . . . 0.0 110.893 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.49 -29.71 33.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -84.11 -53.7 5.34 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -57.38 -29.19 63.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.854 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 m -81.52 -26.76 34.85 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.725 0.693 . . . . 0.0 112.157 176.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 56.9 tp -90.2 -22.4 21.7 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.397 0.679 . . . . 0.0 112.297 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.7 p -109.06 -4.5 16.57 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 123.007 0.523 . . . . 0.0 111.268 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt 63.64 11.85 6.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 123.455 0.472 . . . . 0.0 111.778 168.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.6 t -97.97 -165.53 1.26 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.628 1.171 . . . . 0.0 110.056 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -84.88 152.23 59.0 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.232 0.613 . . . . 0.0 110.67 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.79 -22.66 31.64 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.403 2.735 . . . . 0.0 111.701 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.66 -16.21 57.59 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 117.862 0.301 . . . . 0.0 110.694 176.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.75 -32.4 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 175.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 52.0 m -60.51 -41.31 94.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 172.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.2 ttt-85 -66.61 -23.05 66.13 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 125.26 1.424 . . . . 0.0 112.608 179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -99.39 -4.95 30.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 120.148 1.34 . . . . 0.0 111.642 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.475 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -107.23 -7.89 16.61 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.1 mt -88.57 -38.27 15.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 171.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.31 -6.75 20.02 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.2 mtp85 -86.57 -14.46 42.81 Favored 'General case' 0 N--CA 1.457 -0.075 0 C-N-CA 122.539 0.335 . . . . 0.0 111.702 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -146.88 37.56 0.97 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.962 0.505 . . . . 0.0 111.709 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 58.08 34.42 24.19 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.495 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.9 m95 58.55 38.33 25.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.427 1.091 . . . . 0.0 112.524 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -88.06 111.77 21.91 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 175.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.1 tt -70.19 -15.15 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 118.944 -1.102 . . . . 0.0 112.265 -169.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.06 -41.39 14.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -178.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -68.59 -42.61 77.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.47 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -34.46 77.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.854 0.862 . . . . 0.0 111.623 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.0 mt -73.24 -33.55 65.37 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.316 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -74.4 -34.12 63.2 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 118.061 0.391 . . . . 0.0 110.213 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.597 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 21.6 t70 -72.48 -41.16 66.32 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.475 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 53.8 t80 -65.4 -38.59 90.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.702 -0.624 . . . . 0.0 111.325 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -74.42 -10.84 59.97 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.168 -0.332 . . . . 0.0 110.421 174.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -88.0 -14.96 37.72 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 117.652 0.206 . . . . 0.0 110.966 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.597 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -105.36 -22.29 13.06 Favored 'General case' 0 CA--C 1.523 -0.062 0 C-N-CA 123.688 0.795 . . . . 0.0 111.312 -178.573 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.551 ' C ' ' H ' ' A' ' 56' ' ' GLY . 29.1 mm-40 -104.98 -33.84 8.2 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.525 0.73 . . . . 0.0 110.868 -175.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.6 mt 58.41 0.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 125.805 1.642 . . . . 0.0 113.16 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.551 ' H ' ' C ' ' A' ' 54' ' ' GLU . . . -63.02 3.02 1.13 Allowed Glycine 0 CA--C 1.53 0.983 0 C-N-CA 125.797 1.665 . . . . 0.0 114.007 -177.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 t -105.37 23.54 13.57 Favored 'General case' 0 N--CA 1.461 0.089 0 CA-C-N 118.141 0.971 . . . . 0.0 111.078 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.447 ' C ' ' H ' ' A' ' 60' ' ' ASP . 31.1 p90 -67.2 -23.48 65.75 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -176.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 74.9 p -74.44 30.65 0.08 Allowed 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -174.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.447 ' H ' ' C ' ' A' ' 58' ' ' PHE . 27.5 t70 -115.6 4.95 14.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.105 0.955 . . . . 0.0 111.125 -178.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -91.51 13.05 18.82 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.509 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.253 1.239 0 C-N-CA 125.249 1.42 . . . . 0.0 110.374 -178.677 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.46 ' C ' ' H ' ' A' ' 8' ' ' ARG . 49.4 mt . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -76.26 3.84 10.0 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 125.335 1.454 . . . . 0.0 112.875 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 6' ' ' ILE . 1.4 tmt_? 26.73 33.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 130.621 3.568 . . . . 0.0 114.245 -173.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.2 mttt 44.33 37.3 1.92 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.288 1.035 . . . . 0.0 111.893 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -152.02 -27.21 0.18 Allowed 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 111.979 0.362 . . . . 0.0 111.979 -171.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -163.25 81.5 0.47 Allowed 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 122.396 1.093 . . . . 0.0 109.131 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.512 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -59.43 -178.95 0.14 Allowed Pre-proline 0 N--CA 1.447 -0.584 0 CA-C-N 113.154 -1.839 . . . . 0.0 110.382 173.671 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.512 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.0 Cg_exo -67.01 -28.57 41.52 Favored 'Trans proline' 0 N--CA 1.454 -0.823 1 C-N-CA 125.331 4.021 . . . . 0.0 112.06 -174.215 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.449 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 68.0 mt-10 -95.37 -34.83 11.99 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.647 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -72.58 -13.31 61.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 123.498 0.499 . . . . 0.0 111.247 -176.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.05 -14.91 55.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -48.98 3.44 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 169.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.1 mt -60.46 -50.94 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.056 -175.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -72.11 -20.93 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.672 -1.211 . . . . 0.0 111.115 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -84.19 -28.27 27.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 122.026 0.917 . . . . 0.0 108.65 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -85.62 -58.34 2.7 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.174 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -57.06 -26.14 59.86 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.093 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.4 p -79.1 -38.97 34.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 118.934 0.788 . . . . 0.0 111.627 172.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.7 tp -77.28 -12.71 59.98 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.04 0.536 . . . . 0.0 112.094 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.8 p -123.22 -0.59 8.82 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.257 0.623 . . . . 0.0 111.747 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp 62.98 10.91 4.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.4 p -88.17 -171.82 3.54 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.181 0.593 . . . . 0.0 111.084 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -87.32 146.0 38.96 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -55.9 -23.08 40.88 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.365 2.71 . . . . 0.0 113.691 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -84.72 -11.36 55.99 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.969 0.349 . . . . 0.0 111.255 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -87.87 -38.38 11.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.8 t -57.52 -45.38 85.07 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.9 ttt85 -49.31 -58.48 5.01 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.98 1.312 . . . . 0.0 110.353 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -66.25 -14.38 61.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -174.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 24.4 m-85 -100.56 -17.77 16.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.229 0.922 . . . . 0.0 110.028 175.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 mt -78.58 -35.8 45.32 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.402 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 78.8 mt-30 -65.56 -15.43 62.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.731 0.412 . . . . 0.0 111.645 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -87.15 -10.41 52.78 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 123.674 0.789 . . . . 0.0 111.218 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -140.98 33.62 1.75 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 122.734 0.414 . . . . 0.0 111.398 -172.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 p80 49.19 35.09 6.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 20.6 m95 57.32 38.68 28.64 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.245 1.418 . . . . 0.0 112.724 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.57 119.3 31.37 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.044 -1.835 . . . . 0.0 106.044 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -74.44 -18.28 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 119.024 -1.07 . . . . 0.0 111.734 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -84.87 -42.2 15.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -176.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -68.88 -38.86 79.94 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.803 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.03 -26.67 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.428 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -76.35 -33.44 58.96 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 118.025 0.375 . . . . 0.0 110.341 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -72.72 -34.12 66.89 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.147 0.43 . . . . 0.0 109.953 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.594 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 28.4 t70 -70.82 -40.23 72.58 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.07 -0.394 . . . . 0.0 110.241 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.431 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.1 t80 -66.24 -39.43 89.54 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.689 -0.632 . . . . 0.0 111.245 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -75.81 -6.52 51.1 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 122.219 -0.3 . . . . 0.0 110.674 174.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -90.4 -15.93 30.05 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.609 0.242 . . . . 0.0 110.878 175.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -99.3 -28.0 13.51 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.373 0.669 . . . . 0.0 110.871 -178.221 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -137.97 100.41 4.15 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 122.227 1.013 . . . . 0.0 108.628 173.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.7 mm -63.1 -20.31 25.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 113.987 -1.46 . . . . 0.0 111.281 -178.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.11 -4.04 73.45 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 123.349 0.5 . . . . 0.0 113.053 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -140.58 27.24 2.07 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 117.793 0.796 . . . . 0.0 110.503 177.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -145.84 -37.72 0.25 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.043 . . . . 0.0 109.534 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.4 p -89.41 25.35 1.97 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.81 0.844 . . . . 0.0 110.17 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -87.19 -1.24 57.75 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.073 -177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.06 22.38 13.01 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.527 1.131 . . . . 0.0 112.757 -178.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.862 -1.066 . . . . 0.0 110.602 178.874 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 121.198 0.523 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.407 ' HE3' ' CA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -75.04 150.04 39.03 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.016 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -133.28 73.65 1.53 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.428 1.091 . . . . 0.0 109.536 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -76.47 44.96 0.37 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.75 -177.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -121.32 -10.87 8.86 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.95 0.9 . . . . 0.0 111.736 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 55.97 62.7 2.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 122.497 1.141 . . . . 0.0 110.87 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.536 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -52.67 -178.92 0.04 OUTLIER Pre-proline 0 N--CA 1.448 -0.536 0 C-N-CA 126.586 1.954 . . . . 0.0 110.951 169.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.5 Cg_exo -67.62 -29.87 35.8 Favored 'Trans proline' 0 N--CA 1.453 -0.853 1 C-N-CA 125.519 4.146 . . . . 0.0 111.778 -173.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.45 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 31.5 mt-10 -91.96 -32.93 15.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.356 176.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -76.71 -11.8 59.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.018 0.527 . . . . 0.0 111.16 -174.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.47 -13.18 52.75 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.96 -45.39 3.63 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 170.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.2 mt -61.17 -50.33 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -72.63 -20.74 61.22 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.967 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -83.05 -32.99 26.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -80.09 -59.06 2.86 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.247 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -56.92 -27.35 60.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.212 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.1 m -82.29 -27.09 32.55 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.076 0.853 . . . . 0.0 112.076 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.7 tp -88.47 -21.03 24.41 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.198 0.599 . . . . 0.0 111.923 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -110.34 -3.2 16.3 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 123.168 0.587 . . . . 0.0 110.89 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt 63.58 12.94 6.87 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 123.647 0.592 . . . . 0.0 111.72 168.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.8 p -88.89 -165.59 1.38 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.911 0.884 . . . . 0.0 110.427 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.05 146.62 31.62 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -53.29 -18.61 10.94 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.444 2.763 . . . . 0.0 114.257 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -82.77 -13.77 55.68 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.8 0.727 . . . . 0.0 111.846 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -92.05 -36.36 7.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -54.18 -56.58 16.83 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -57.45 -39.28 75.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.803 -174.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -73.74 -14.33 61.11 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.034 0.834 . . . . 0.0 112.787 -178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.405 ' CD2' ' NH2' ' A' ' 38' ' ' ARG . 11.0 m-85 -98.44 -26.11 14.57 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 118.762 0.71 . . . . 0.0 109.857 172.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.28 -33.93 61.29 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -67.35 -12.13 59.42 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.166 0.586 . . . . 0.0 111.511 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.405 ' NH2' ' CD2' ' A' ' 35' ' ' TYR . 33.2 mtm-85 -97.79 -10.39 24.89 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 122.873 0.469 . . . . 0.0 111.463 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -131.03 27.88 4.83 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.368 0.667 . . . . 0.0 110.872 -174.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 53.59 31.7 13.0 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.702 0.801 . . . . 0.0 112.125 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 16.9 m95 58.77 31.53 21.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.347 1.059 . . . . 0.0 112.378 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.53 110.69 18.87 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -70.42 -15.7 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 119.378 -0.929 . . . . 0.0 111.867 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -85.07 -42.29 14.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.74 -39.91 80.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.646 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.8 -26.03 60.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.757 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.9 -34.84 64.55 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -72.98 -27.21 61.67 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -82.63 -12.18 57.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.746 0.419 . . . . 0.0 111.761 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -98.46 -36.15 10.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.76 1.224 . . . . 0.0 110.926 172.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -71.57 -10.09 59.23 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 172.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -76.51 -15.97 59.76 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 120.922 0.391 . . . . 0.0 110.434 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -102.88 -33.85 9.19 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.764 0.826 . . . . 0.0 110.156 -178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -76.49 -36.12 58.01 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.996 0.918 . . . . 0.0 111.327 -177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 49.3 mm -86.31 -14.19 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 122.756 0.422 . . . . 0.0 110.009 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.87 -6.44 78.38 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.707 0.67 . . . . 0.0 112.537 -177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.9 t -139.5 27.28 2.29 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.415 0.686 . . . . 0.0 110.286 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.476 ' C ' ' H ' ' A' ' 60' ' ' ASP . 13.5 t80 -75.95 -25.52 56.0 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.336 -174.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.2 p -79.51 24.01 0.38 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.226 0.61 . . . . 0.0 111.241 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.476 ' H ' ' C ' ' A' ' 58' ' ' PHE . 28.4 t70 -111.7 3.8 18.08 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.846 177.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -93.96 13.75 21.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.334 -1.303 . . . . 0.0 111.375 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.252 1.22 0 CA-C-O 117.147 -1.406 . . . . 0.0 109.766 -178.613 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -63.68 128.79 37.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.149 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -97.26 54.84 1.24 Allowed 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.294 1.038 . . . . 0.0 110.391 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -124.39 20.04 8.84 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.149 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -153.94 -30.75 0.12 Allowed 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.672 0.789 . . . . 0.0 110.941 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -155.45 102.87 2.28 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.885 0.85 . . . . 0.0 109.273 174.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.527 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -56.03 164.23 1.88 Allowed Pre-proline 0 C--N 1.328 -0.337 0 C-N-CA 125.244 1.418 . . . . 0.0 111.797 176.082 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -64.4 -25.58 63.56 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.215 3.277 . . . . 0.0 110.063 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -90.52 -45.34 9.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.388 -1.733 . . . . 0.0 109.914 177.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.527 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.75 -15.63 62.7 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.007 0.523 . . . . 0.0 110.894 -173.138 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.62 -13.53 60.06 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.95 -56.74 2.33 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.077 170.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -51.91 -51.21 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 C-N-CA 123.395 0.678 . . . . 0.0 112.411 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -75.55 -20.32 58.74 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 118.153 -1.419 . . . . 0.0 111.127 -173.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.6 t -80.89 -32.35 34.84 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -80.96 -59.22 2.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.6 1.16 . . . . 0.0 109.307 -174.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.8 t -56.48 -28.61 60.21 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.505 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.2 m -81.93 -26.09 34.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.836 0.744 . . . . 0.0 111.776 175.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.75 -23.3 25.52 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.13 0.572 . . . . 0.0 111.87 178.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.9 p -107.6 -3.98 18.76 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.066 0.546 . . . . 0.0 110.791 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt 63.67 12.27 6.44 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.658 0.383 . . . . 0.0 111.473 169.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -94.44 -167.89 1.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.401 1.08 . . . . 0.0 110.792 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -88.17 142.09 31.53 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.034 0.934 . . . . 0.0 109.423 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -64.98 -17.05 58.34 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.276 2.651 . . . . 0.0 113.187 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 30' ' ' LYS . 11.2 mmpt? -83.22 -9.92 58.87 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.394 0.543 . . . . 0.0 110.329 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -91.86 -35.2 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -57.49 -46.54 83.6 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 76.4 ttt-85 -47.52 -58.45 4.2 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 125.316 1.446 . . . . 0.0 110.052 175.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -68.78 -11.74 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -175.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.465 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 19.5 m-85 -102.77 -17.01 15.78 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.398 0.999 . . . . 0.0 109.714 174.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.9 mt -80.07 -35.69 36.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -65.96 -17.09 64.44 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.761 0.425 . . . . 0.0 111.389 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.3 mtp85 -83.45 -9.52 58.95 Favored 'General case' 0 C--O 1.23 0.042 0 C-N-CA 123.502 0.721 . . . . 0.0 111.062 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -142.01 27.7 1.78 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 54.41 31.34 14.4 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.36 0.664 . . . . 0.0 112.402 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 14.9 m95 60.16 34.5 21.13 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.795 1.238 . . . . 0.0 112.621 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.98 116.91 25.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 172.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -73.29 -17.6 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 118.913 -1.115 . . . . 0.0 111.677 -169.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.59 -42.32 15.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.84 -39.57 79.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.595 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.4 -27.06 62.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.607 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.8 mt -76.08 -33.88 59.53 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.259 0.481 . . . . 0.0 110.508 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -71.66 -35.34 70.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.597 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 28.2 t70 -70.97 -41.38 71.12 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.465 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 59.7 t80 -65.24 -39.1 92.26 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 121.635 -0.666 . . . . 0.0 111.182 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -77.14 -4.95 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.389 -0.195 . . . . 0.0 110.782 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.21 -17.54 25.87 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.708 0.231 . . . . 0.0 111.001 174.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.597 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -97.4 -27.06 14.64 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.307 0.643 . . . . 0.0 110.955 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -139.3 101.36 4.23 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 172.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mm -61.45 -18.41 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 113.974 -1.466 . . . . 0.0 111.253 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.42 7.98 87.64 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-O 119.657 -0.524 . . . . 0.0 112.991 177.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.2 t -133.82 20.82 3.85 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 117.901 0.851 . . . . 0.0 111.852 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -76.48 -29.97 57.09 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.28 0.562 . . . . 0.0 111.393 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 9.7 t -91.29 30.74 1.22 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.198 -174.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.2 t70 47.73 37.38 6.89 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 122.889 1.328 . . . . 0.0 112.09 -175.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 45.97 28.21 0.59 Allowed 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.675 2.39 . . . . 0.0 114.896 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.953 -1.022 . . . . 0.0 111.167 179.898 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 59.3 mt . . . . . 0 C--O 1.232 0.174 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.4 ' HE3' ' CA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -80.37 142.53 34.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 169.687 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -97.2 20.07 12.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.914 0.886 . . . . 0.0 112.426 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.5 mttt 47.66 23.72 0.45 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.244 1.818 . . . . 0.0 114.7 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -155.6 -59.55 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.057 0.39 . . . . 0.0 111.524 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -166.35 74.09 0.17 Allowed 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 122.393 1.092 . . . . 0.0 109.478 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.539 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -60.25 -177.71 0.13 Allowed Pre-proline 0 N--CA 1.445 -0.682 0 CA-C-N 113.247 -1.797 . . . . 0.0 110.106 172.438 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.5 Cg_exo -67.88 -30.46 33.19 Favored 'Trans proline' 0 N--CA 1.455 -0.785 1 C-N-CA 125.51 4.14 . . . . 0.0 111.166 -175.159 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -88.66 -38.54 14.71 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.477 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 -8.22 57.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -171.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.52 -12.87 53.38 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.88 -49.82 2.85 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.304 170.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.47 HG22 ' HG ' ' A' ' 32' ' ' SER . 11.3 mt -56.07 -52.47 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 CA-C-N 118.648 0.658 . . . . 0.0 112.282 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -74.55 -20.62 59.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 118.387 -1.325 . . . . 0.0 110.803 -172.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 t -80.89 -33.46 34.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -78.25 -63.42 1.4 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.485 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -52.67 -27.65 18.25 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.304 1.041 . . . . 0.0 112.917 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m -84.2 -28.05 27.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.277 0.944 . . . . 0.0 112.039 174.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.82 -18.97 35.82 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.028 0.531 . . . . 0.0 111.473 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.2 p -116.83 -1.87 11.95 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.36 12.33 6.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.542 0.526 . . . . 0.0 112.357 169.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.0 p -86.03 -175.37 5.53 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.956 0.503 . . . . 0.0 110.886 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -83.55 145.82 48.72 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -57.81 -9.29 5.52 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.796 2.997 . . . . 0.0 114.749 -178.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -99.25 -12.71 20.14 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.597 0.635 . . . . 0.0 111.473 177.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -89.47 -38.13 10.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.47 ' HG ' HG22 ' A' ' 18' ' ' ILE . 84.7 p -54.36 -49.5 69.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.083 0.944 . . . . 0.0 108.601 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -53.74 -52.36 60.39 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.982 2.513 . . . . 0.0 111.618 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -67.76 -18.01 64.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.694 0.679 . . . . 0.0 112.456 -177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 22.4 m-85 -95.05 -20.41 19.35 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.041 0.837 . . . . 0.0 110.25 174.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.5 mp -75.36 -39.15 59.59 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -64.45 -18.72 65.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.169 0.588 . . . . 0.0 111.717 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.5 mtp85 -81.12 -9.44 59.81 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.373 0.669 . . . . 0.0 111.174 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -140.52 27.55 2.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.634 0.374 . . . . 0.0 111.839 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 53.9 33.39 17.12 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.549 0.74 . . . . 0.0 112.116 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.7 m95 59.87 31.6 20.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.519 1.128 . . . . 0.0 112.67 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -86.6 112.08 21.25 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tt -69.75 -16.97 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.912 -170.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -85.26 -42.75 14.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -177.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.55 -38.88 81.18 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.6 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.66 -26.94 61.82 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.6 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -74.22 -34.31 63.65 Favored 'General case' 0 C--N 1.338 0.078 0 CA-C-N 118.222 0.465 . . . . 0.0 109.935 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -71.48 -35.79 70.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.154 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.583 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 30.4 t70 -70.93 -42.09 70.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.459 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.3 t80 -66.38 -38.65 88.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.574 -0.704 . . . . 0.0 111.424 177.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -76.78 -5.68 49.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.555 0.161 . . . . 0.0 110.818 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -90.51 -16.72 28.34 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 117.925 0.33 . . . . 0.0 111.215 175.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.583 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -98.0 -21.78 16.63 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 123.793 0.837 . . . . 0.0 111.322 -177.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -146.57 81.6 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 124.377 1.071 . . . . 0.0 108.937 176.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.0 mt -70.04 -23.24 25.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.806 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.22 -1.68 79.7 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.463 0.554 . . . . 0.0 112.963 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -139.57 23.63 2.48 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.156 0.979 . . . . 0.0 110.719 178.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.413 ' C ' ' H ' ' A' ' 60' ' ' ASP . 46.6 t80 -144.92 -39.38 0.26 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.992 -1.004 . . . . 0.0 108.871 -178.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p -86.48 24.11 1.48 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.52 0.728 . . . . 0.0 110.374 172.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' A' ' 58' ' ' PHE . 29.7 t70 -115.91 6.78 14.3 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 124.474 1.11 . . . . 0.0 110.639 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -93.61 12.96 23.54 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.648 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.9 m . . . . . 0 C--O 1.252 1.189 0 C-N-CA 125.457 1.503 . . . . 0.0 110.96 -178.151 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mt . . . . . 0 N--CA 1.457 -0.116 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.457 ' C ' ' H ' ' A' ' 9' ' ' LYS . 49.2 mtmt -68.79 104.2 1.97 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.113 0.965 . . . . 0.0 110.029 179.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.44 21.48 0.14 Allowed 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -178.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.457 ' H ' ' C ' ' A' ' 7' ' ' LYS . 92.0 mttt -146.62 14.04 1.21 Allowed 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.426 1.09 . . . . 0.0 111.271 -174.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -156.42 -33.25 0.09 Allowed 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 122.965 0.506 . . . . 0.0 111.251 -176.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -157.69 97.29 1.57 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.849 0.833 . . . . 0.0 110.375 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER -52.1 163.94 0.64 Allowed Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 125.233 1.413 . . . . 0.0 112.057 176.115 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -63.52 -25.45 70.06 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.958 3.105 . . . . 0.0 110.009 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.401 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 62.6 mt-10 -90.73 -45.92 8.56 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 113.625 -1.625 . . . . 0.0 109.885 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.531 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.73 -16.19 62.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.171 0.588 . . . . 0.0 110.88 -172.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.42 -14.0 60.09 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.81 -54.55 2.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 123.644 0.59 . . . . 0.0 110.176 171.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 mt -52.78 -53.3 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-O 118.737 -0.649 . . . . 0.0 112.267 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -73.18 -21.26 60.72 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 118.088 -1.445 . . . . 0.0 111.072 -173.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.0 t -81.46 -29.6 33.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -85.34 -56.96 3.27 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.153 0.981 . . . . 0.0 109.542 -174.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 t -57.06 -27.43 61.69 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.293 178.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -83.6 -30.33 27.05 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 119.076 0.853 . . . . 0.0 111.533 174.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -81.4 -16.09 53.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.855 0.462 . . . . 0.0 111.325 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -120.11 -1.28 10.37 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.558 0.743 . . . . 0.0 111.705 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp 63.05 10.07 4.23 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.455 0.472 . . . . 0.0 112.242 169.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.5 p -89.33 -172.44 3.62 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.183 0.593 . . . . 0.0 110.925 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -86.94 145.19 37.96 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -55.22 -23.16 35.63 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.387 2.725 . . . . 0.0 113.864 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -83.97 -12.5 55.22 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.026 0.375 . . . . 0.0 111.127 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.7 t -86.48 -38.65 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.5 t -57.71 -47.1 83.32 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 74.1 ttt-85 -53.52 -23.88 11.76 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 125.072 1.349 . . . . 0.0 112.263 177.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -99.94 -11.04 21.0 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 120.419 1.463 . . . . 0.0 112.315 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 40.3 m-85 -102.0 -7.36 22.43 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.082 0.401 . . . . 0.0 109.974 171.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.434 HD21 ' CE3' ' A' ' 41' ' ' TRP . 4.7 mp -86.9 -41.98 13.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 77.0 mt-30 -64.74 -10.43 27.45 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -76.81 -21.85 54.49 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.719 0.808 . . . . 0.0 111.372 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -144.45 35.73 1.19 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.137 0.575 . . . . 0.0 112.399 -171.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 57.55 36.16 26.56 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CE3' HD21 ' A' ' 36' ' ' LEU . 17.0 m95 60.13 46.0 11.09 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.009 0.923 . . . . 0.0 112.602 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -98.68 111.05 23.55 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 175.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 tt -67.06 -17.83 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 120.237 -0.585 . . . . 0.0 112.15 -171.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -86.68 -44.02 12.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.347 -0.845 . . . . 0.0 108.896 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.4 m-30 -66.45 -38.54 87.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.537 177.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.37 -30.74 68.8 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.265 0.626 . . . . 0.0 112.004 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -72.73 -31.54 65.04 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.777 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -74.6 -36.77 62.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.59 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 35.3 t70 -69.16 -44.37 72.4 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 117.803 0.274 . . . . 0.0 110.609 -179.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.455 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 30.3 t80 -68.85 -36.63 78.37 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.694 -0.629 . . . . 0.0 111.506 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -74.88 -7.92 54.94 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.061 -0.399 . . . . 0.0 110.282 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -92.39 -11.42 34.94 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.084 0.154 . . . . 0.0 111.15 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -113.23 -41.31 3.72 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.103 0.561 . . . . 0.0 112.06 -176.152 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -101.14 -38.39 8.15 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.186 0.594 . . . . 0.0 111.59 -173.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.6 -14.28 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 122.805 0.442 . . . . 0.0 110.102 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.453 ' HA2' ' CZ ' ' A' ' 58' ' ' PHE . . . -72.04 9.76 5.03 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.217 0.913 . . . . 0.0 113.028 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.6 t -93.39 22.65 5.08 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.82 0.848 . . . . 0.0 112.392 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.453 ' CZ ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -56.86 -37.41 71.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.145 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.2 p -81.21 34.71 0.37 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.718 0.807 . . . . 0.0 112.878 -177.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -117.49 4.15 12.45 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.877 0.846 . . . . 0.0 110.884 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -95.21 12.83 27.49 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.274 -1.33 . . . . 0.0 111.454 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 C--O 1.249 1.057 0 CA-C-O 116.966 -1.492 . . . . 0.0 111.295 -178.067 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.0 mp . . . . . 0 CA--C 1.531 0.212 0 CA-C-O 121.276 0.56 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.559 ' HE2' ' HA ' ' A' ' 7' ' ' LYS . 8.4 mmpt? -70.55 137.66 50.29 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -105.0 25.74 10.13 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -169.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.3 mttt 50.93 50.15 19.67 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.005 0.922 . . . . 0.0 111.135 -176.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -145.01 -30.79 0.43 Allowed 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.955 0.902 . . . . 0.0 111.132 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.93 101.18 1.93 Allowed 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -51.35 164.15 0.51 Allowed Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 125.229 1.412 . . . . 0.0 112.055 176.744 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -63.76 -26.53 68.07 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 124.003 3.135 . . . . 0.0 109.917 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.429 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 52.4 mt-10 -89.07 -47.51 8.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.169 -1.832 . . . . 0.0 109.892 177.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.25 -16.27 63.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.753 0.658 . . . . 0.0 111.157 -172.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.9 -12.34 59.94 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.95 -51.64 2.77 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.617 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.428 HG21 ' HG ' ' A' ' 32' ' ' SER . 5.8 mt -54.84 -53.15 35.84 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 118.713 -0.661 . . . . 0.0 111.628 -178.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -73.93 -20.78 60.28 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.203 -172.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -82.3 -28.62 31.6 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -84.15 -63.81 1.28 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.925 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -49.63 -28.23 5.58 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.341 1.057 . . . . 0.0 112.733 177.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.3 p -79.51 -39.55 31.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.27 0.941 . . . . 0.0 111.803 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.0 tp -78.19 -18.74 55.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.471 0.709 . . . . 0.0 111.983 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.0 p -111.13 -3.04 15.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.273 0.629 . . . . 0.0 110.801 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 63.82 11.59 6.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.543 0.527 . . . . 0.0 111.935 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -94.49 -174.44 3.33 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.941 0.497 . . . . 0.0 111.606 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -80.94 151.41 70.48 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.098 0.559 . . . . 0.0 111.055 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.88 -2.18 9.82 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.983 3.122 . . . . 0.0 112.217 -177.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -102.37 -7.8 21.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.2 0.6 . . . . 0.0 111.07 175.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.3 t -102.54 -35.28 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.097 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.428 ' HG ' HG21 ' A' ' 18' ' ' ILE . 82.2 p -51.18 -47.81 62.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 122.656 1.217 . . . . 0.0 108.816 172.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -54.82 -52.32 63.07 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 128.757 2.823 . . . . 0.0 112.058 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.05 -14.35 61.84 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.59 0.632 . . . . 0.0 112.474 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.42 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 32.1 m-85 -98.33 -5.3 33.15 Favored 'General case' 0 C--N 1.337 0.037 0 C-N-CA 123.255 0.622 . . . . 0.0 110.233 172.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.0 mp -93.31 -48.15 6.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 173.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -55.86 -25.1 40.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.956 0.502 . . . . 0.0 110.89 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.286 20.3 ttm180 -65.1 -20.64 66.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.988 2.515 . . . . 0.0 113.64 -178.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -144.56 29.95 1.24 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.975 0.91 . . . . 0.0 110.217 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 61.82 36.6 15.99 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.061 0.545 . . . . 0.0 112.059 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.8 m95 61.05 42.71 12.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.854 1.261 . . . . 0.0 111.884 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -95.35 112.48 24.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.93 -16.71 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.886 -171.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.77 -43.28 12.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -67.12 -39.23 86.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.601 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.4 -31.17 70.33 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.808 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.39 -28.2 60.99 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.906 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.85 -38.4 53.83 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.159 176.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.587 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 19.7 t70 -72.36 -41.75 66.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.916 -0.49 . . . . 0.0 110.995 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.42 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 43.8 t80 -68.3 -36.66 79.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 121.581 -0.699 . . . . 0.0 111.375 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -74.97 -9.16 58.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -90.95 -11.91 37.6 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.61 0.187 . . . . 0.0 111.018 174.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -111.74 -39.95 4.44 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.882 0.473 . . . . 0.0 112.119 -176.002 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -104.55 -40.32 6.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.973 0.509 . . . . 0.0 111.838 -172.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.9 mm -86.83 -13.58 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.909 0.385 . . . . 0.0 110.187 176.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.83 -3.38 55.17 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.667 0.651 . . . . 0.0 112.709 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.9 t -137.27 27.73 2.84 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.659 0.784 . . . . 0.0 109.83 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -115.85 -39.48 3.48 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.201 1.001 . . . . 0.0 111.327 -175.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.4 p -123.17 27.22 7.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.477 1.111 . . . . 0.0 109.947 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -67.49 110.68 3.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.657 -178.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 45.55 29.44 0.63 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.207 1.803 . . . . 0.0 114.42 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.091 -0.957 . . . . 0.0 111.241 178.895 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 CA--C 1.532 0.26 0 CA-C-O 121.35 0.595 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' A' ' 9' ' ' LYS . 68.7 mmtt -96.3 113.5 25.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.814 -0.554 . . . . 0.0 109.85 178.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.8 mmt-85 -81.53 25.58 0.51 Allowed 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.888 1.275 . . . . 0.0 112.626 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.405 ' H ' ' C ' ' A' ' 7' ' ' LYS . 90.3 mttt -146.7 12.61 1.15 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.679 1.191 . . . . 0.0 110.474 -176.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -156.68 -21.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.937 0.895 . . . . 0.0 112.808 -174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 58.94 28.42 17.58 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.405 1.082 . . . . 0.0 112.327 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.0 OUTLIER 35.54 172.58 0.0 OUTLIER Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 129.907 3.283 . . . . 0.0 116.341 -177.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -74.15 -27.37 11.81 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.307 2.672 . . . . 0.0 110.513 172.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.414 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 47.5 mt-10 -89.14 -46.37 8.87 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.837 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.9 OUTLIER -70.46 -13.94 62.33 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 125.022 1.329 . . . . 0.0 110.223 -172.039 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -81.43 -12.31 58.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.19 -50.5 2.9 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.281 169.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.597 ' HA ' ' HG ' ' A' ' 32' ' ' SER . 6.7 mt -56.06 -51.94 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -74.99 -19.64 60.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 118.514 -1.274 . . . . 0.0 110.775 -173.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -82.1 -32.31 30.28 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -81.58 -56.26 4.13 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.783 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -58.27 -28.69 65.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.409 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -82.92 -26.32 31.59 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 118.856 0.753 . . . . 0.0 111.629 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.4 tp -86.49 -18.65 31.08 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.097 0.559 . . . . 0.0 111.686 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -111.28 -4.17 15.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.149 0.58 . . . . 0.0 111.228 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt 63.4 10.35 4.73 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.558 0.536 . . . . 0.0 111.642 169.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 t -95.04 -170.73 2.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.967 0.907 . . . . 0.0 110.569 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.9 t70 -84.71 144.65 42.77 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.149 0.58 . . . . 0.0 110.454 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 69.6 Cg_exo -56.06 -24.45 49.17 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.652 2.901 . . . . 0.0 114.098 -177.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -81.51 -18.8 43.81 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 117.901 0.319 . . . . 0.0 110.481 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -81.99 -34.62 12.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.597 ' HG ' ' HA ' ' A' ' 18' ' ' ILE . 28.1 t -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -47.63 -54.88 10.64 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.541 1.136 . . . . 0.0 110.767 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -66.59 -18.79 65.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -176.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.423 ' HH ' ' CB ' ' A' ' 53' ' ' LYS . 15.7 m-85 -94.58 -21.75 18.64 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.462 1.028 . . . . 0.0 109.976 175.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 mp -74.18 -37.2 64.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -66.84 -16.67 64.45 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.124 -0.36 . . . . 0.0 111.801 177.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -84.13 -9.55 58.49 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.183 0.593 . . . . 0.0 110.912 177.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -141.45 26.84 1.93 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.796 0.439 . . . . 0.0 111.706 -171.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 53.62 33.01 15.53 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.605 0.762 . . . . 0.0 112.533 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.414 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 16.2 m95 60.44 33.6 20.63 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.533 1.133 . . . . 0.0 112.379 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -88.82 110.77 21.32 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 172.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.5 tt -69.46 -16.58 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 C-N-CA 119.758 -0.777 . . . . 0.0 112.23 -171.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -85.04 -42.79 14.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.7 -39.74 80.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.815 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.9 -27.66 62.01 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.68 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.1 mt -75.63 -33.59 60.51 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -70.08 -37.46 75.45 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.464 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 24.2 t0 -70.94 -32.14 68.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.298 -0.251 . . . . 0.0 110.713 -178.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -80.6 -35.73 33.73 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.479 -0.763 . . . . 0.0 111.758 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.34 -12.75 45.3 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.441 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 29.2 t70 -93.69 -8.6 40.42 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 175.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.464 ' HE3' ' O ' ' A' ' 49' ' ' ASP . 0.0 OUTLIER -113.39 -58.15 2.19 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.342 0.657 . . . . 0.0 110.776 -176.444 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 37.95 27.88 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.314 2.246 . . . . 0.0 114.858 -172.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.4 mm -64.81 -15.07 17.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.424 ' HA2' ' CE2' ' A' ' 58' ' ' PHE . . . -74.5 9.6 10.11 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 123.771 0.701 . . . . 0.0 113.037 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.5 t -88.13 20.17 3.32 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.937 0.895 . . . . 0.0 112.735 -175.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.424 ' CE2' ' HA2' ' A' ' 56' ' ' GLY . 0.1 OUTLIER -61.71 -43.04 99.61 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.924 -0.485 . . . . 0.0 111.691 -173.605 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.5 p -90.18 32.51 0.92 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.247 0.619 . . . . 0.0 112.427 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -114.31 4.56 15.46 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.845 0.831 . . . . 0.0 111.358 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -92.17 13.99 17.44 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.42 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 59.8 t . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.006 1.322 . . . . 0.0 109.878 -178.993 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.6 mt . . . . . 0 N--CA 1.454 -0.226 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.23 142.93 57.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.567 0.747 . . . . 0.0 110.563 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.479 ' H ' ' HD2' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -131.59 23.14 4.7 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.748 0.819 . . . . 0.0 112.357 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -145.44 18.54 1.53 Allowed 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.308 1.043 . . . . 0.0 111.384 -172.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -149.15 -29.3 0.26 Allowed 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 122.746 0.418 . . . . 0.0 112.035 -174.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 51.21 -129.45 2.28 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-O 123.102 1.43 . . . . 0.0 109.746 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.55 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -169.36 166.95 5.72 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 112.115 -2.311 . . . . 0.0 109.903 -174.666 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -66.67 -25.66 46.66 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 124.21 3.274 . . . . 0.0 110.039 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.469 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 41.4 mt-10 -90.93 -47.35 7.64 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 113.41 -1.723 . . . . 0.0 109.873 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.55 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.12 -14.06 62.48 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.42 0.688 . . . . 0.0 110.828 -173.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.25 -14.61 59.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.77 -56.68 2.33 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.052 170.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.1 mt -52.24 -50.08 38.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -76.16 -20.31 57.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 118.272 -1.371 . . . . 0.0 110.695 -174.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -82.41 -26.97 32.3 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -87.1 -52.7 5.28 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -174.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 t -58.87 -30.15 67.52 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.195 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -84.23 -28.54 27.19 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.834 0.743 . . . . 0.0 111.992 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.4 tt -84.33 -22.57 30.57 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.094 -0.379 . . . . 0.0 111.209 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.3 p -112.59 -3.23 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.298 0.639 . . . . 0.0 111.77 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp 63.89 9.24 4.37 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.481 0.488 . . . . 0.0 112.032 169.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 t -90.19 -168.86 2.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.991 0.916 . . . . 0.0 109.934 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -86.6 144.38 37.44 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 122.893 0.477 . . . . 0.0 110.365 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -56.97 -26.55 68.67 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.445 2.763 . . . . 0.0 113.498 -177.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -79.51 -18.89 50.95 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.15 0.432 . . . . 0.0 110.797 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.0 t -82.81 -33.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.0 m -60.2 -46.77 88.61 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.5 ttt-85 -60.47 -37.54 81.33 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 125.479 1.512 . . . . 0.0 112.088 179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -86.19 -8.2 57.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 119.519 1.054 . . . . 0.0 113.114 -175.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.424 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 14.8 m-85 -99.73 -22.64 15.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 24.7 mt -75.47 -34.85 60.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.428 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 50.6 mt-30 -68.33 -11.89 60.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -94.98 -5.56 44.37 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.796 0.438 . . . . 0.0 110.955 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -136.84 27.26 2.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.528 0.731 . . . . 0.0 111.408 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 54.39 31.32 14.32 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.661 0.784 . . . . 0.0 112.35 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.1 m95 58.97 31.85 21.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.532 1.133 . . . . 0.0 112.649 -178.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.93 117.41 23.91 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 173.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tt -73.62 -17.1 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 118.802 -1.159 . . . . 0.0 112.013 -169.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -85.68 -41.89 14.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.83 -40.15 79.62 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.683 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.14 -27.78 62.83 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.541 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.6 mt -75.53 -31.63 60.17 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.361 177.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -72.94 -31.7 64.77 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.069 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.587 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 38.7 t70 -71.94 -34.79 69.31 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.424 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 56.5 t80 -71.65 -44.84 63.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.796 -0.565 . . . . 0.0 111.268 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -64.89 -16.28 63.04 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 117.814 0.279 . . . . 0.0 110.39 176.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.6 -11.56 55.75 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.636 0.374 . . . . 0.0 110.777 177.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -110.56 -12.08 14.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.416 0.687 . . . . 0.0 112.367 -174.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -78.26 -5.75 52.91 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.43 0.559 . . . . 0.0 111.04 175.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.5 mm -69.08 -14.65 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 C-N-CA 123.373 0.669 . . . . 0.0 110.601 -179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.43 ' C ' ' H ' ' A' ' 58' ' ' PHE . . . 76.83 9.4 86.53 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 179.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.4 t -79.63 27.28 0.28 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.825 0.821 . . . . 0.0 111.195 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.43 ' H ' ' C ' ' A' ' 56' ' ' GLY . 7.8 t80 -87.38 -29.95 21.12 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.956 0.902 . . . . 0.0 111.145 -176.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.5 p -97.28 23.58 7.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.837 0.855 . . . . 0.0 109.888 175.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -77.28 1.62 18.13 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.888 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -120.7 19.48 11.85 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.918 1.287 . . . . 0.0 111.197 177.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.607 1.963 . . . . 0.0 111.918 -178.83 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.7 tt . . . . . 0 N--CA 1.452 -0.372 0 CA-C-O 121.543 0.687 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -63.25 119.1 8.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.384 0.673 . . . . 0.0 109.895 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.1 mmm-85 -99.65 24.81 7.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.731 1.212 . . . . 0.0 111.88 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 49.13 28.83 2.28 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.921 1.288 . . . . 0.0 112.601 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -153.4 -32.2 0.12 Allowed 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 122.762 0.425 . . . . 0.0 111.304 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.73 103.66 2.1 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 122.305 1.05 . . . . 0.0 109.957 176.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.486 ' HB3' ' CG ' ' A' ' 15' ' ' GLN . 1.1 t -52.26 165.45 0.51 Allowed Pre-proline 0 N--CA 1.452 -0.337 0 C-N-CA 126.127 1.771 . . . . 0.0 112.28 174.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -63.5 -25.98 70.13 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.805 3.004 . . . . 0.0 110.043 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 32.9 mt-10 -91.36 -46.37 8.06 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.796 -1.547 . . . . 0.0 109.773 177.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.486 ' CG ' ' HB3' ' A' ' 12' ' ' SER . 11.6 mm-40 -70.37 -12.5 61.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 123.343 0.402 . . . . 0.0 111.796 -174.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -79.36 -15.18 58.32 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.25 -51.56 2.86 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.794 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.6 mt -56.16 -48.93 78.51 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.948 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -75.67 -21.25 57.81 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.374 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 t -81.3 -34.68 31.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -76.3 -62.33 1.65 Allowed 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.111 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.9 t -54.44 -29.66 50.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.867 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -81.2 -25.64 36.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 119.056 0.844 . . . . 0.0 112.073 175.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.6 tp -89.97 -22.53 21.89 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.927 0.491 . . . . 0.0 112.077 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.6 p -109.02 -3.75 17.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.238 0.615 . . . . 0.0 111.056 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt 63.51 13.5 7.25 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.707 0.403 . . . . 0.0 111.854 168.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.7 p -87.38 -169.5 2.64 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.627 0.771 . . . . 0.0 110.65 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -88.15 144.39 34.29 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -59.29 -7.93 5.9 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.995 3.13 . . . . 0.0 114.683 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.535 ' HE2' ' HA ' ' A' ' 30' ' ' LYS . 10.7 mmpt? -97.95 -10.76 23.98 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.657 0.662 . . . . 0.0 111.208 176.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -91.53 -38.72 10.86 Favored 'Isoleucine or valine' 0 C--N 1.337 0.06 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -53.4 -44.03 68.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 122.324 1.059 . . . . 0.0 109.157 174.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 62.8 ttt-85 -63.85 -33.14 75.02 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.101 2.56 . . . . 0.0 112.066 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -88.73 -9.87 50.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 119.224 0.92 . . . . 0.0 112.522 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.414 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 12.2 m-85 -97.58 -24.64 15.46 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.2 -35.56 63.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.2 mt-30 -67.38 -12.81 61.15 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -94.63 -7.6 40.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.981 0.513 . . . . 0.0 111.348 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -133.41 27.18 4.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.291 0.636 . . . . 0.0 111.144 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 53.21 31.16 11.06 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.668 0.787 . . . . 0.0 112.223 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.7 m95 58.43 33.21 22.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.593 1.157 . . . . 0.0 112.275 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.07 116.01 22.65 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.21 -16.96 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.929 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.04 -41.18 16.03 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -69.74 -40.37 76.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.679 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.48 -27.68 62.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 122.703 0.401 . . . . 0.0 111.364 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.68 -34.31 64.83 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -73.11 -30.52 63.7 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -17.52 59.38 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 122.579 0.352 . . . . 0.0 111.759 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.414 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.9 t80 -95.28 -36.17 11.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.477 1.111 . . . . 0.0 111.621 174.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -75.05 -5.13 42.43 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.239 -0.288 . . . . 0.0 110.372 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.28 -16.86 44.64 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.677 0.391 . . . . 0.0 111.122 175.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -96.97 -33.65 11.5 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.994 0.917 . . . . 0.0 110.199 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -132.61 97.25 4.02 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 122.283 1.039 . . . . 0.0 109.215 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mm -63.15 -19.87 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 113.877 -1.51 . . . . 0.0 110.574 178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 87.14 -3.75 86.64 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.496 0.569 . . . . 0.0 112.103 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -151.68 28.41 0.62 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.453 0.626 . . . . 0.0 111.317 179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -122.8 -125.55 0.26 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.746 1.218 . . . . 0.0 107.838 -176.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.5 p -97.63 28.27 3.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.615 0.766 . . . . 0.0 111.925 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -96.12 -2.19 47.02 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 124.038 0.935 . . . . 0.0 112.088 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -95.36 15.4 19.57 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 125.687 1.595 . . . . 0.0 111.315 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.89 1.276 . . . . 0.0 109.897 -178.265 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.2 mm . . . . . 0 CA--C 1.531 0.238 0 CA-C-O 122.339 1.066 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.51 ' C ' ' H ' ' A' ' 9' ' ' LYS . 34.9 mmtp -82.82 42.58 0.79 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.073 0.949 . . . . 0.0 111.266 -178.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -74.64 24.45 0.09 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 124.269 1.027 . . . . 0.0 112.009 178.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 7' ' ' LYS . 86.8 mttt -144.47 14.7 1.61 Allowed 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.376 1.071 . . . . 0.0 111.161 -172.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -148.47 -24.49 0.33 Allowed 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 59.77 69.96 0.67 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.518 1.151 . . . . 0.0 110.393 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -51.61 -175.08 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.471 0 C-N-CA 127.654 2.382 . . . . 0.0 110.726 169.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 90.3 Cg_endo -83.43 -21.11 4.53 Favored 'Trans proline' 0 N--CA 1.451 -1.0 1 C-N-CA 125.534 4.156 . . . . 0.0 109.805 -168.142 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.479 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 20.9 mt-10 -98.81 -28.21 13.59 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.312 175.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.582 ' N ' HE21 ' A' ' 15' ' ' GLN . 1.2 mm-40 -79.07 -14.38 59.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -175.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -81.05 -11.18 59.57 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.67 -49.16 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.072 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.42 -47.93 88.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 CA-C-N 118.843 0.747 . . . . 0.0 111.77 -178.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -75.14 -20.3 59.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.827 -175.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -84.41 -28.9 26.59 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -83.66 -54.12 5.16 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.3 t -56.71 -30.37 63.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.424 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.8 m -83.4 -26.95 29.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 0.77 . . . . 0.0 111.811 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.4 tp -87.24 -16.41 35.32 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.0 p -119.95 -1.49 10.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 122.806 0.442 . . . . 0.0 111.721 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.96 10.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 169.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.04 -168.58 2.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.159 0.584 . . . . 0.0 110.355 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.79 143.88 34.2 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.61 -24.06 43.27 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.303 2.669 . . . . 0.0 113.71 -177.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -78.68 -19.25 52.93 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 121.867 -0.52 . . . . 0.0 110.738 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -82.66 -32.67 10.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 175.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.2 m -62.5 -47.35 84.35 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 46.3 ttt85 -57.5 -39.18 75.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 111.948 178.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -81.26 -19.06 43.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 119.527 1.058 . . . . 0.0 113.234 -177.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.63 -24.61 19.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 119.258 0.935 . . . . 0.0 109.861 176.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mp -70.19 -36.8 74.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.7 mt-30 -67.57 -12.61 60.78 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -93.8 -7.06 44.49 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.169 0.588 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -134.47 25.51 3.77 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.252 0.621 . . . . 0.0 111.337 -175.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 54.08 31.62 14.12 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.363 0.665 . . . . 0.0 111.729 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.479 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 14.5 m95 59.24 32.84 22.31 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.816 1.246 . . . . 0.0 112.416 -177.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.3 110.76 19.31 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.4 tt -69.45 -16.61 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.031 -170.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.62 -42.57 14.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.13 -39.38 82.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.488 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.83 61.01 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.598 -177.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.1 mt -73.18 -33.35 65.38 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -72.09 -32.91 67.46 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.589 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.8 t70 -70.02 -37.68 75.68 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.344 -0.223 . . . . 0.0 110.457 178.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -73.26 -41.04 64.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.845 -0.534 . . . . 0.0 111.657 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.12 -9.48 55.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.093 0.406 . . . . 0.0 110.37 175.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.55 -14.34 32.76 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.838 0.455 . . . . 0.0 110.662 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.589 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -106.34 -7.11 17.86 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -171.208 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.97 -7.92 53.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 118.01 0.368 . . . . 0.0 111.226 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 mt -141.66 -47.51 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.866 0.866 . . . . 0.0 109.461 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.409 ' HA2' ' CE2' ' A' ' 58' ' ' PHE . . . -87.8 81.86 1.6 Allowed Glycine 0 C--N 1.335 0.503 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.4 t -87.96 15.15 7.62 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 121.724 0.773 . . . . 0.0 112.176 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.409 ' CE2' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -81.2 -40.6 23.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.754 178.324 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.4 p -87.4 35.54 0.72 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.991 0.917 . . . . 0.0 111.36 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -121.17 11.69 10.92 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.975 0.91 . . . . 0.0 111.549 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -84.68 24.64 1.0 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.082 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 C--O 1.252 1.2 0 CA-C-O 117.43 -1.271 . . . . 0.0 109.438 -178.833 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 N--CA 1.454 -0.233 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -69.75 159.61 33.24 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.505 0.669 . . . . 0.0 110.717 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 mmm-85 -113.91 26.82 10.01 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.411 1.085 . . . . 0.0 108.984 170.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 52.09 48.51 22.57 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 123.619 0.768 . . . . 0.0 110.93 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -105.49 -0.64 25.72 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 124.249 1.02 . . . . 0.0 110.308 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 62.82 70.22 0.56 Allowed 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.493 1.517 . . . . 0.0 110.698 -177.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.54 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -54.77 -178.6 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.595 0 C-N-CA 127.046 2.138 . . . . 0.0 110.877 172.044 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.54 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.9 Cg_exo -66.98 -30.54 39.13 Favored 'Trans proline' 0 N--CA 1.456 -0.716 1 C-N-CA 125.479 4.119 . . . . 0.0 111.898 -173.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.446 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 57.7 mt-10 -92.7 -35.27 13.57 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.349 176.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -75.14 -8.44 56.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.13 0.572 . . . . 0.0 111.399 -175.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.95 -14.68 43.96 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.02 -47.7 3.39 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.768 171.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.6 mt -58.16 -51.81 66.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.706 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -70.8 -23.39 62.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 118.779 -1.168 . . . . 0.0 111.164 -175.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.2 t -81.04 -34.29 32.92 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -79.12 -61.3 2.06 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.403 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -53.75 -28.73 36.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.079 0.951 . . . . 0.0 112.618 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.5 m -83.31 -28.08 29.32 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 119.078 0.854 . . . . 0.0 111.812 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 tp -84.28 -16.7 42.18 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.055 0.542 . . . . 0.0 111.781 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.4 p -118.51 -2.04 11.1 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 122.875 0.47 . . . . 0.0 111.752 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp 63.23 10.4 4.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 169.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -89.17 -174.55 4.47 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.812 0.445 . . . . 0.0 110.745 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -80.92 150.46 69.01 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 122.271 0.228 . . . . 0.0 110.89 178.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.4 -22.55 50.71 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -86.72 -10.08 54.5 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -97.85 -36.34 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.8 p -54.9 -36.97 65.76 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 122.341 1.067 . . . . 0.0 109.411 174.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.4 ttt85 -67.73 -54.16 21.61 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 127.909 2.483 . . . . 0.0 110.942 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -67.29 -10.0 46.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.429 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 28.5 m-85 -105.24 -9.3 17.77 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.65 0.659 . . . . 0.0 110.442 174.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -86.44 -38.77 17.0 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -63.7 -16.26 60.61 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.334 0.654 . . . . 0.0 112.761 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -78.32 -15.86 58.3 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.037 0.535 . . . . 0.0 111.605 -178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -143.67 36.52 1.31 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.746 0.419 . . . . 0.0 111.812 -173.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 57.66 33.34 23.11 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 13.9 m95 60.52 39.74 17.77 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.323 1.049 . . . . 0.0 112.306 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -89.6 111.18 22.05 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 174.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -68.19 -16.59 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.932 -169.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.17 -42.33 13.93 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.71 -41.29 83.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.817 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.83 74.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.748 0.819 . . . . 0.0 111.63 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.07 -33.49 63.69 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.148 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.8 -36.7 65.03 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.058 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.569 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 20.5 t70 -68.64 -43.52 76.14 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.429 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.8 t80 -64.06 -41.3 97.4 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.954 -0.466 . . . . 0.0 111.27 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -72.06 -4.07 26.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.171 0.189 . . . . 0.0 111.031 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -96.82 -5.87 37.33 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 122.401 -0.187 . . . . 0.0 111.343 173.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.569 ' HE3' ' O ' ' A' ' 49' ' ' ASP . 0.0 OUTLIER -117.22 -29.88 5.77 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.459 0.703 . . . . 0.0 112.403 -174.837 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.71 -3.15 52.91 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 36.7 mm -60.58 -21.99 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 123.901 0.881 . . . . 0.0 110.532 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.01 90.71 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 122.104 -0.373 . . . . 0.0 112.879 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.8 t -90.33 23.76 2.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.901 0.858 . . . . 0.0 110.855 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -84.66 -27.12 27.32 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.012 0.925 . . . . 0.0 111.319 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.9 p -85.8 21.56 1.86 Allowed 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.437 0.695 . . . . 0.0 110.653 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -90.94 1.29 57.15 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.545 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -92.56 13.41 19.93 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 124.889 1.275 . . . . 0.0 111.62 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.251 1.166 0 CA-C-O 117.074 -1.441 . . . . 0.0 110.931 -178.878 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.653 0.739 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -56.88 133.28 54.42 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.566 0.747 . . . . 0.0 109.908 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -121.51 64.07 0.9 Allowed 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.472 1.109 . . . . 0.0 109.837 -172.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 48.17 49.55 17.37 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 114.672 -1.149 . . . . 0.0 111.778 176.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -98.73 -7.06 28.32 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.5 0.72 . . . . 0.0 110.167 -176.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 50.62 73.47 0.28 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.463 1.505 . . . . 0.0 111.424 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER -44.67 164.58 0.17 Allowed Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 125.96 1.704 . . . . 0.0 112.47 171.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -62.09 -25.72 77.59 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.134 3.222 . . . . 0.0 109.69 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.454 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 44.9 mt-10 -90.15 -43.96 10.1 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.877 177.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.516 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -73.24 -15.75 61.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.644 0.59 . . . . 0.0 110.926 -172.037 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -76.47 -13.29 60.11 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.07 -54.56 2.6 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.094 170.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 mt -53.44 -52.26 33.96 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.58 0 CA-C-O 118.854 -0.593 . . . . 0.0 112.181 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -74.07 -21.0 60.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.936 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -80.18 -33.39 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -80.74 -59.51 2.65 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.207 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.8 t -55.62 -28.84 57.51 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.377 1.071 . . . . 0.0 112.323 179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 m -82.05 -26.24 33.9 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.2 0.909 . . . . 0.0 111.898 174.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -86.87 -22.69 25.6 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.133 0.573 . . . . 0.0 112.051 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -109.0 -3.52 17.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 123.509 0.724 . . . . 0.0 110.864 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt 64.0 12.34 6.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.421 0.451 . . . . 0.0 112.121 168.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -90.02 -165.23 1.3 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.43 0.692 . . . . 0.0 111.041 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -92.7 145.01 29.54 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.16 0.584 . . . . 0.0 109.628 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.09 -25.59 46.15 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.423 2.749 . . . . 0.0 113.807 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.4 -11.73 59.66 Favored 'General case' 0 C--O 1.228 -0.071 0 CA-C-N 118.147 0.431 . . . . 0.0 111.203 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -90.74 -37.53 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.1 t -58.35 -44.67 88.85 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -48.87 -58.28 5.09 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 125.066 1.346 . . . . 0.0 110.603 175.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -68.18 -13.4 62.21 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 21.3 m-85 -100.97 -18.03 16.5 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.225 0.921 . . . . 0.0 110.118 175.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.2 mt -79.67 -35.28 39.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -66.05 -17.22 64.55 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.507 0.323 . . . . 0.0 111.461 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 -83.0 -10.18 58.91 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.385 0.674 . . . . 0.0 110.941 177.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -141.28 27.91 1.89 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.7 0.4 . . . . 0.0 111.864 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 54.32 31.25 14.0 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.518 0.727 . . . . 0.0 112.283 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.5 m95 60.09 34.31 21.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.52 1.128 . . . . 0.0 112.827 -178.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -86.91 116.39 24.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -72.74 -17.37 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 118.958 -1.097 . . . . 0.0 111.898 -170.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.79 -42.27 15.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -68.97 -39.76 79.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.63 63.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.432 -177.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 31.0 mt -75.71 -33.78 60.34 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 118.014 0.37 . . . . 0.0 110.191 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -71.79 -35.34 69.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.234 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.593 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 27.2 t70 -70.28 -42.86 71.55 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.707 0.289 . . . . 0.0 110.35 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.44 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 47.2 t80 -64.43 -38.49 91.21 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.548 -0.72 . . . . 0.0 111.408 177.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -77.57 -5.6 50.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.256 0.222 . . . . 0.0 110.841 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -91.03 -16.56 27.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 117.777 0.262 . . . . 0.0 111.206 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.593 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -98.44 -22.74 15.88 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.685 0.794 . . . . 0.0 111.268 -177.817 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -144.99 83.26 1.69 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.519 1.152 . . . . 0.0 108.653 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.2 mt -70.02 -17.09 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 113.864 -1.516 . . . . 0.0 110.863 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 0.64 74.95 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 123.796 0.712 . . . . 0.0 111.698 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.5 t -140.26 23.27 2.37 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 123.726 0.81 . . . . 0.0 110.606 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -92.41 -34.35 14.18 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.231 1.012 . . . . 0.0 110.597 -177.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 22.5 p -95.09 24.72 4.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.714 0.806 . . . . 0.0 110.036 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -68.73 110.72 4.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.925 0.869 . . . . 0.0 110.379 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 44.65 26.98 0.21 Allowed 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.851 2.461 . . . . 0.0 114.95 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.8 m . . . . . 0 C--O 1.25 1.118 0 CA-C-O 117.055 -1.45 . . . . 0.0 111.345 177.744 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 111.495 0.183 . . . . 0.0 111.495 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -64.29 -24.92 64.7 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.856 3.037 . . . . 0.0 109.927 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -92.55 -45.75 7.96 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.104 176.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.4 mm-40 -69.41 -13.49 62.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.727 -175.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.94 -14.47 59.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.73 -49.77 3.11 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 171.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt -58.6 -50.72 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.103 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.69 -20.97 61.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.571 -1.252 . . . . 0.0 111.201 -175.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.1 t -82.51 -32.16 28.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -81.33 -58.18 3.16 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.3 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -58.38 -26.88 63.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.031 0.932 . . . . 0.0 112.567 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.9 m -83.03 -28.49 29.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 118.711 0.687 . . . . 0.0 111.562 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.5 tp -83.95 -14.91 49.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.023 0.529 . . . . 0.0 111.757 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 p -121.91 -0.72 9.5 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.299 0.639 . . . . 0.0 111.927 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp 63.45 11.77 5.83 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 169.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.3 p -86.99 -172.57 4.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.979 0.512 . . . . 0.0 110.652 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.0 t70 -86.15 145.58 40.81 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 74.4 Cg_exo -54.6 -23.81 34.02 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.309 2.673 . . . . 0.0 113.845 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -83.85 -12.12 56.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.494 0.318 . . . . 0.0 111.277 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.04 -39.04 13.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.0 t -57.81 -44.68 86.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 174.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 75.9 ttt-85 -55.66 -23.88 30.67 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.912 1.285 . . . . 0.0 112.091 176.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -102.5 -6.51 22.81 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 120.052 1.296 . . . . 0.0 112.679 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -103.06 -16.22 15.84 Favored 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.8 mt -80.21 -39.58 28.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 40.8 mt-30 -68.0 -11.85 59.66 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 176.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -87.49 -12.78 44.96 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.631 0.372 . . . . 0.0 111.127 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -141.23 36.29 1.71 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.832 0.453 . . . . 0.0 111.37 -171.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 47.75 42.33 15.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 112.327 176.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.423 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 26.6 m95 50.86 35.77 13.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.524 1.53 . . . . 0.0 112.925 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -91.65 118.17 30.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tt -73.84 -18.16 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.805 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -84.75 -41.77 15.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -70.67 -36.94 73.58 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.81 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -26.83 61.36 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.523 0.329 . . . . 0.0 111.364 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.4 mt -76.63 -34.75 58.31 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 117.967 0.349 . . . . 0.0 110.392 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.04 -34.37 71.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.87 -40.38 72.31 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 122.2 -0.313 . . . . 0.0 110.274 178.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 28.2 t80 -68.95 -37.63 78.94 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.554 -0.716 . . . . 0.0 111.02 177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -73.19 -8.98 58.16 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 122.288 -0.257 . . . . 0.0 110.35 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.53 0.209 0 C-N-CA 122.24 0.216 . . . . 0.0 111.063 175.238 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.578 0 CA-C-O 120.919 0.39 . . . . 0.0 110.195 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.8 Cg_exo -68.01 -28.89 34.73 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.338 4.025 . . . . 0.0 111.924 -174.935 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 30.6 mt-10 -93.29 -32.98 14.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.457 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -73.81 -15.8 61.17 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.157 0.583 . . . . 0.0 111.034 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -80.25 -13.67 59.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -107.5 -49.1 3.31 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.653 169.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.9 mt -60.21 -49.55 83.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.169 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.0 mt-10 -72.98 -21.14 60.89 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.123 -175.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -81.87 -33.31 30.63 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -80.48 -59.29 2.75 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.707 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -56.26 -29.1 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.436 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -82.01 -28.26 32.65 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.113 0.87 . . . . 0.0 111.819 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.9 tp -83.65 -17.54 41.15 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.741 0.416 . . . . 0.0 111.92 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.3 p -121.23 -0.33 9.94 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 122.999 0.519 . . . . 0.0 111.675 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.1 11.75 5.47 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 169.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.4 p -86.73 -169.7 2.75 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.222 0.609 . . . . 0.0 111.098 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 12.8 t70 -88.87 145.14 34.12 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 75.9 Cg_exo -54.07 -24.2 31.88 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.529 2.82 . . . . 0.0 114.136 -177.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 -16.97 45.78 Favored 'General case' 0 CA--C 1.522 -0.133 0 O-C-N 121.998 -0.439 . . . . 0.0 110.933 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.7 t -81.73 -35.63 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.0 t -60.52 -48.85 79.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.415 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.8 ttt85 -49.39 -57.75 6.37 Favored 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 124.727 1.211 . . . . 0.0 110.214 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -65.79 -13.95 60.45 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -102.19 -18.61 15.44 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.459 1.027 . . . . 0.0 109.981 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 34.0 mt -76.63 -34.95 58.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.0 mt-30 -67.14 -15.96 64.03 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.848 0.459 . . . . 0.0 111.719 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.2 mtp85 -87.86 -10.49 50.6 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.772 0.829 . . . . 0.0 111.094 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -141.03 34.47 1.74 Allowed 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.874 0.47 . . . . 0.0 111.374 -172.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 46.95 40.25 8.97 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.484 0.714 . . . . 0.0 112.183 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 23.4 m95 52.1 36.77 19.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 125.541 1.536 . . . . 0.0 113.153 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -92.15 120.25 32.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 172.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tt -74.61 -18.44 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 119.058 -1.057 . . . . 0.0 111.603 -170.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -84.4 -42.12 16.0 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -69.9 -37.94 76.16 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.915 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.52 -25.78 60.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 122.612 0.365 . . . . 0.0 111.386 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.9 mt -77.32 -33.41 55.56 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 118.009 0.368 . . . . 0.0 110.292 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -72.22 -34.65 68.5 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 122.033 -0.417 . . . . 0.0 110.06 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -70.14 -38.0 75.39 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 178.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -69.52 -41.81 75.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 121.72 -0.612 . . . . 0.0 111.491 177.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -69.54 -11.24 60.67 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 117.891 0.314 . . . . 0.0 110.328 176.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.53 0.18 0 C-N-CA 122.551 0.34 . . . . 0.0 110.865 175.925 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.523 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 121.02 0.438 . . . . 0.0 110.764 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.4 Cg_exo -66.48 -28.78 45.58 Favored 'Trans proline' 0 N--CA 1.456 -0.693 1 C-N-CA 125.632 4.221 . . . . 0.0 112.015 -173.34 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 59.2 mt-10 -95.2 -31.36 13.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.735 176.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -76.69 -12.22 59.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 123.497 0.498 . . . . 0.0 110.791 -175.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -82.52 -14.65 54.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.74 -49.25 3.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.977 169.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -60.31 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.88 -176.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.493 ' HA ' HG22 ' A' ' 22' ' ' THR . 22.5 mt-10 -72.44 -20.59 61.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.049 -175.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 t -83.35 -30.38 27.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -83.3 -59.19 2.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.377 1.071 . . . . 0.0 109.75 -176.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.11 -28.79 59.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.547 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.8 m -83.31 -29.63 28.17 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 119.244 0.929 . . . . 0.0 112.018 175.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -81.24 -16.56 52.31 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.587 0.355 . . . . 0.0 111.108 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -120.62 -1.95 9.99 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.148 0.579 . . . . 0.0 112.016 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp 62.81 10.36 4.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.0 p -89.98 -164.02 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.72 0.808 . . . . 0.0 111.503 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -91.11 144.92 30.66 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.733 0.813 . . . . 0.0 110.427 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.58 -22.27 27.63 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.137 2.558 . . . . 0.0 113.669 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -77.95 -31.35 50.84 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.7 p -83.75 -25.43 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.139 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.3 t -61.82 -51.27 68.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 47.3 ttt85 -51.4 -58.78 5.3 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 125.386 1.475 . . . . 0.0 110.585 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -63.06 -17.84 62.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -176.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 11.7 m-85 -100.42 -18.11 16.88 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.373 0.988 . . . . 0.0 110.245 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.4 mt -75.25 -34.81 61.43 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 172.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 81.4 mt-30 -67.55 -14.69 63.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.858 0.463 . . . . 0.0 111.55 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -90.18 -9.65 47.39 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 124.036 0.935 . . . . 0.0 111.355 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -140.28 33.74 1.89 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.909 0.484 . . . . 0.0 111.362 -172.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.8 p80 49.01 35.54 7.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.347 1.059 . . . . 0.0 112.489 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.477 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 21.0 m95 56.06 38.26 29.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.681 1.593 . . . . 0.0 112.416 -178.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -88.99 120.12 30.12 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 171.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -75.14 -17.83 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 118.757 -1.177 . . . . 0.0 111.775 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.11 -41.0 16.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -176.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.7 -38.41 73.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.024 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.67 -26.54 61.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.487 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.1 mt -76.63 -35.07 58.25 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.01 0.368 . . . . 0.0 110.162 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.6 -36.3 70.79 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -69.4 -40.67 77.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.426 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 64.3 t80 -68.83 -41.22 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.767 -0.583 . . . . 0.0 111.274 177.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -69.53 -8.32 46.11 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 117.651 0.205 . . . . 0.0 110.641 175.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 CA--C 1.531 0.238 0 C-N-CA 122.179 0.192 . . . . 0.0 110.943 175.452 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.506 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.522 0 CA-C-O 121.342 0.592 . . . . 0.0 111.213 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.4 Cg_exo -67.43 -28.6 38.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.329 4.02 . . . . 0.0 111.602 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.473 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 29.3 mt-10 -92.84 -32.31 14.67 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.381 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -76.63 -13.65 60.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.752 0.421 . . . . 0.0 111.186 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -82.55 -12.34 57.82 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.17 -50.12 3.04 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 28.9 mt -57.82 -48.79 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 CA-C-O 118.736 -0.649 . . . . 0.0 112.295 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.505 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -74.08 -20.94 60.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.111 -175.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -82.83 -31.52 28.03 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -82.63 -56.29 3.94 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.27 -175.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.44 -28.05 64.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.144 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 m -81.34 -27.96 34.7 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.992 0.815 . . . . 0.0 111.983 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.5 tp -86.66 -20.01 28.42 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.071 0.548 . . . . 0.0 111.877 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.9 p -110.05 -4.03 16.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 123.319 0.648 . . . . 0.0 111.302 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.1 mmtt 63.03 11.56 5.25 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.509 0.505 . . . . 0.0 111.649 169.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.0 t -93.15 -164.31 1.16 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.222 1.009 . . . . 0.0 109.926 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -96.84 145.53 29.74 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 122.92 0.488 . . . . 0.0 110.303 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 73.7 Cg_exo -54.06 -17.83 12.09 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.592 2.862 . . . . 0.0 114.509 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -83.66 -10.09 58.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.893 0.77 . . . . 0.0 111.844 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -96.94 -36.48 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.8 t -52.62 -52.17 56.68 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.463 0.649 . . . . 0.0 109.763 177.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.6 ptp180 -59.89 -36.42 76.91 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.676 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -77.19 -11.56 59.83 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 119.373 0.988 . . . . 0.0 112.724 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 17.3 m-85 -102.32 -20.51 14.58 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 118.967 0.803 . . . . 0.0 109.682 172.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -76.23 -37.13 58.09 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 72.3 mt-30 -68.49 -12.99 62.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.237 0.615 . . . . 0.0 111.324 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -90.07 -10.55 44.34 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 123.695 0.798 . . . . 0.0 111.388 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -140.17 30.38 1.99 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.814 0.445 . . . . 0.0 111.593 -171.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 53.56 32.12 13.71 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 123.705 0.802 . . . . 0.0 112.584 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.473 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 18.8 m95 58.9 31.93 21.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.723 1.209 . . . . 0.0 112.776 -178.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -84.6 114.01 21.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 172.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -71.87 -16.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 C-N-CA 118.744 -1.182 . . . . 0.0 111.636 -169.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -84.85 -42.71 14.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -68.26 -40.39 81.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.662 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.89 63.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.567 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.85 -34.7 62.33 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.058 0.39 . . . . 0.0 110.273 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -72.29 -29.45 63.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -78.51 -17.54 56.08 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.122 0.569 . . . . 0.0 111.194 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 40.3 t80 -92.59 -37.87 12.21 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.668 1.187 . . . . 0.0 111.006 172.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -66.93 -14.42 62.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.902 0.382 . . . . 0.0 111.19 178.378 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 15' ' ' GLN . 1.3 t . . . . . 0 CA--C 1.528 0.114 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -62.31 -25.22 76.4 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.825 3.017 . . . . 0.0 109.899 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -91.54 -45.41 8.52 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 113.849 -1.523 . . . . 0.0 109.821 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HG2' ' HB3' ' A' ' 12' ' ' SER . 7.9 mm100 -70.22 -12.87 61.89 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.827 0.451 . . . . 0.0 111.507 -174.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -80.58 -13.24 59.23 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.717 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.11 -46.83 3.17 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 171.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 mt -58.35 -51.97 64.79 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 118.898 -0.572 . . . . 0.0 111.377 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.5 mt-10 -72.11 -22.27 61.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.131 -174.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 t -81.37 -33.38 32.39 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -78.65 -61.66 1.94 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.552 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -54.15 -27.26 32.4 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 112.898 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.2 m -84.24 -28.35 27.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 118.947 0.794 . . . . 0.0 111.564 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.0 tp -83.84 -16.58 43.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.742 0.417 . . . . 0.0 111.685 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 p -118.7 -1.62 11.08 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.314 0.645 . . . . 0.0 111.607 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp 63.24 12.42 6.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.353 0.408 . . . . 0.0 112.036 169.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.45 -177.36 6.17 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 122.985 0.514 . . . . 0.0 111.104 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.43 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.1 t70 -80.93 146.52 59.58 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -58.31 -7.91 4.49 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.985 3.123 . . . . 0.0 114.756 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -101.64 -11.2 19.38 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 118.381 0.537 . . . . 0.0 111.359 177.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -89.78 -37.51 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.9 p -52.06 -51.39 57.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 108.673 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.406 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 27.7 ttt85 -51.55 -53.56 36.68 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 128.133 2.573 . . . . 0.0 111.354 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -68.61 -12.43 61.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.677 0.671 . . . . 0.0 112.789 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 27.6 m-85 -102.57 -7.93 21.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 118.727 0.694 . . . . 0.0 111.041 173.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -87.63 -37.99 16.3 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 80.1 mt-30 -64.69 -12.57 47.92 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -84.09 -15.46 47.28 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.36 0.664 . . . . 0.0 111.898 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -145.43 41.7 1.25 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.921 0.489 . . . . 0.0 110.969 -173.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 24.9 p80 51.29 37.76 19.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 176.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.408 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 17.0 m95 58.34 45.51 16.82 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.901 1.28 . . . . 0.0 112.066 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -96.65 113.5 25.07 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 175.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.33 -17.5 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.129 -170.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.3 -43.06 13.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -67.06 -40.04 86.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.617 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.65 72.47 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.485 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.9 mt -73.59 -31.32 63.52 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.122 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -75.75 -37.3 59.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -71.09 -40.15 71.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.078 -0.389 . . . . 0.0 110.612 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 37.8 t80 -68.1 -40.85 82.52 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.709 -0.619 . . . . 0.0 111.555 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -71.33 -9.42 58.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.943 0.338 . . . . 0.0 110.17 176.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 CA--C 1.529 0.165 0 C-N-CA 122.448 0.299 . . . . 0.0 111.14 174.946 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.48 -25.37 70.36 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 123.986 3.124 . . . . 0.0 109.822 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -91.99 -45.88 8.1 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.154 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.0 mm-40 -69.93 -12.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.793 0.437 . . . . 0.0 111.666 -175.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -79.67 -14.63 58.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.688 177.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.54 -47.61 3.35 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.031 171.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -60.34 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.194 -178.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -73.31 -20.7 60.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 118.381 -1.328 . . . . 0.0 111.099 -175.133 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -81.55 -33.29 31.81 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -80.37 -58.15 3.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.681 -176.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.13 -27.44 63.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.06 0.944 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 m -83.04 -28.5 29.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.96 0.8 . . . . 0.0 111.347 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.1 tp -83.45 -14.98 51.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.7 0.4 . . . . 0.0 111.723 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.3 p -121.38 -0.66 9.79 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 123.232 0.613 . . . . 0.0 111.545 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.55 11.14 5.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 169.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.1 p -87.77 -172.27 3.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.107 0.563 . . . . 0.0 110.511 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -89.05 145.41 34.36 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 83.1 Cg_exo -51.79 -25.31 20.57 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.322 2.681 . . . . 0.0 114.483 -178.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -79.96 -17.45 52.94 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.959 0.799 . . . . 0.0 111.536 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.5 t -84.52 -35.41 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.0 t -59.18 -52.2 66.7 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.4 ttt85 -47.56 -55.9 8.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.975 1.31 . . . . 0.0 110.742 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -66.04 -20.38 66.16 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -90.57 -28.16 18.65 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-N 119.466 1.03 . . . . 0.0 109.603 175.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.64 -35.5 75.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.2 mt-30 -66.76 -15.23 63.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.2 mtm-85 -91.4 -7.52 50.51 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.589 0.356 . . . . 0.0 111.066 178.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -134.02 24.43 3.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.239 0.616 . . . . 0.0 111.227 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 53.52 31.65 12.75 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.373 0.669 . . . . 0.0 111.914 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.6 m95 60.44 34.64 20.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.723 1.209 . . . . 0.0 112.227 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -87.57 110.51 20.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tt -70.22 -16.04 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 119.436 -0.906 . . . . 0.0 111.938 -171.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -85.28 -42.41 14.66 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.67 -39.71 80.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.66 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.85 -26.89 60.81 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.89 -177.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.2 mt -75.04 -34.67 61.89 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -69.98 -32.49 70.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -71.81 -35.29 69.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -77.29 -37.83 51.94 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -63.85 -15.13 58.12 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 118.36 0.527 . . . . 0.0 109.681 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.453 -0.283 0 C-N-CA 122.421 0.288 . . . . 0.0 111.577 175.737 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.446 -0.639 0 CA-C-O 120.981 0.419 . . . . 0.0 110.668 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.9 Cg_exo -67.33 -29.06 38.96 Favored 'Trans proline' 0 N--CA 1.454 -0.829 1 C-N-CA 125.703 4.268 . . . . 0.0 111.673 -174.17 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 53.7 mt-10 -94.54 -33.33 13.09 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.728 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -74.56 -13.44 60.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 122.773 0.429 . . . . 0.0 111.038 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.71 -14.79 56.1 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -50.37 3.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.769 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.7 mt -58.95 -49.72 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 118.734 -0.65 . . . . 0.0 112.236 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.503 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.7 mt-10 -73.56 -21.12 60.45 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.054 -175.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.74 -33.34 31.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -80.82 -58.43 3.1 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 124.462 1.105 . . . . 0.0 109.643 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.503 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -58.23 -27.72 64.21 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.635 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -82.1 -28.22 32.42 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.888 0.767 . . . . 0.0 111.464 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 48.0 tp -83.12 -15.68 49.77 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 111.79 177.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.1 p -118.85 -1.54 11.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 122.927 0.491 . . . . 0.0 111.59 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 63.23 11.21 5.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.717 0.407 . . . . 0.0 111.891 169.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -92.98 -173.02 3.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.877 0.871 . . . . 0.0 110.205 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -84.79 143.67 40.96 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 122.939 0.496 . . . . 0.0 110.503 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.53 -26.75 56.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.452 2.768 . . . . 0.0 113.896 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-N 118.149 0.431 . . . . 0.0 110.989 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -87.78 -36.94 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.8 t -58.08 -48.67 79.44 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 45.6 ttt85 -47.99 -55.62 9.61 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.322 1.449 . . . . 0.0 110.642 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -70.27 -13.41 62.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -97.67 -26.12 14.87 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 119.267 0.94 . . . . 0.0 109.269 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.42 -33.14 66.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 83.1 mt-30 -68.58 -14.34 62.95 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.053 -0.404 . . . . 0.0 111.707 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -92.87 -7.59 45.81 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 123.149 0.579 . . . . 0.0 111.127 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -134.29 25.56 3.83 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.418 0.687 . . . . 0.0 111.743 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 53.71 30.53 11.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.597 0.759 . . . . 0.0 112.279 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 15.9 m95 59.53 33.77 22.25 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.918 1.287 . . . . 0.0 112.643 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -85.22 116.18 23.43 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.55 -2.018 . . . . 0.0 105.55 172.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -74.18 -16.4 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 118.94 -1.104 . . . . 0.0 111.689 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -84.88 -40.74 16.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.65 -40.34 73.1 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.964 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.49 62.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.1 mt -75.74 -36.16 60.0 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.086 0.403 . . . . 0.0 110.116 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.07 -31.01 68.4 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -70.44 -35.92 73.66 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -76.58 -37.7 56.1 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 121.763 -0.586 . . . . 0.0 111.964 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -63.68 -15.44 58.39 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.0 t70 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 176.299 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -67.26 -25.5 42.74 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.858 3.039 . . . . 0.0 109.818 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 33.1 mt-10 -91.67 -47.15 7.54 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.252 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.2 mm100 -70.56 -11.24 60.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.266 0.354 . . . . 0.0 111.628 -174.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.35 -14.3 58.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.49 -51.52 2.86 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.664 0.603 . . . . 0.0 109.922 172.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.7 mt -55.65 -48.44 77.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.919 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.08 -22.5 59.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 118.718 -1.193 . . . . 0.0 110.893 -175.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.49 -29.71 33.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -84.11 -53.7 5.34 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -57.38 -29.19 63.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.854 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 m -81.52 -26.76 34.85 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.725 0.693 . . . . 0.0 112.157 176.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 56.9 tp -90.2 -22.4 21.7 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.397 0.679 . . . . 0.0 112.297 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.7 p -109.06 -4.5 16.57 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 123.007 0.523 . . . . 0.0 111.268 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt 63.64 11.85 6.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 123.455 0.472 . . . . 0.0 111.778 168.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.6 t -97.97 -165.53 1.26 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.628 1.171 . . . . 0.0 110.056 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -84.88 152.23 59.0 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.232 0.613 . . . . 0.0 110.67 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.79 -22.66 31.64 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.403 2.735 . . . . 0.0 111.701 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.66 -16.21 57.59 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 117.862 0.301 . . . . 0.0 110.694 176.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.75 -32.4 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 175.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 52.0 m -60.51 -41.31 94.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 172.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 38.2 ttt-85 -66.61 -23.05 66.13 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 125.26 1.424 . . . . 0.0 112.608 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -99.39 -4.95 30.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 120.148 1.34 . . . . 0.0 111.642 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -107.23 -7.89 16.61 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.1 mt -88.57 -38.27 15.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 171.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 43.3 mt-30 -67.31 -6.75 20.02 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.2 mtp85 -86.57 -14.46 42.81 Favored 'General case' 0 N--CA 1.457 -0.075 0 C-N-CA 122.539 0.335 . . . . 0.0 111.702 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -146.88 37.56 0.97 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.962 0.505 . . . . 0.0 111.709 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 58.08 34.42 24.19 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.485 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.9 m95 58.55 38.33 25.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.427 1.091 . . . . 0.0 112.524 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -88.06 111.77 21.91 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 175.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.1 tt -70.19 -15.15 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 118.944 -1.102 . . . . 0.0 112.265 -169.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.06 -41.39 14.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -178.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -68.59 -42.61 77.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.47 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -34.46 77.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.854 0.862 . . . . 0.0 111.623 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.0 mt -73.24 -33.55 65.37 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.316 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -74.4 -34.12 63.2 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 118.061 0.391 . . . . 0.0 110.213 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.48 -41.16 66.32 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.459 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 53.8 t80 -65.4 -38.59 90.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.702 -0.624 . . . . 0.0 111.325 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -74.42 -10.84 59.97 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.168 -0.332 . . . . 0.0 110.421 174.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 . . . . . 0 N--CA 1.461 0.117 0 CA-C-N 117.652 0.206 . . . . 0.0 110.966 176.906 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.512 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.971 0.415 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.512 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.0 Cg_exo -67.01 -28.57 41.52 Favored 'Trans proline' 0 N--CA 1.454 -0.823 1 C-N-CA 125.331 4.021 . . . . 0.0 112.06 -174.215 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 68.0 mt-10 -95.37 -34.83 11.99 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.647 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -72.58 -13.31 61.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 123.498 0.499 . . . . 0.0 111.247 -176.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.05 -14.91 55.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -48.98 3.44 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 169.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.1 mt -60.46 -50.94 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.056 -175.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.11 -20.93 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.672 -1.211 . . . . 0.0 111.115 -174.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -84.19 -28.27 27.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 122.026 0.917 . . . . 0.0 108.65 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -85.62 -58.34 2.7 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.174 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -57.06 -26.14 59.86 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.093 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.4 p -79.1 -38.97 34.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 118.934 0.788 . . . . 0.0 111.627 172.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.7 tp -77.28 -12.71 59.98 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.04 0.536 . . . . 0.0 112.094 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.8 p -123.22 -0.59 8.82 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.257 0.623 . . . . 0.0 111.747 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp 62.98 10.91 4.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.4 p -88.17 -171.82 3.54 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.181 0.593 . . . . 0.0 111.084 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -87.32 146.0 38.96 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -55.9 -23.08 40.88 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.365 2.71 . . . . 0.0 113.691 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -84.72 -11.36 55.99 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.969 0.349 . . . . 0.0 111.255 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -87.87 -38.38 11.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.8 t -57.52 -45.38 85.07 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.9 ttt85 -49.31 -58.48 5.01 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.98 1.312 . . . . 0.0 110.353 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -66.25 -14.38 61.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -174.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.41 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 24.4 m-85 -100.56 -17.77 16.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.229 0.922 . . . . 0.0 110.028 175.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 mt -78.58 -35.8 45.32 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 78.8 mt-30 -65.56 -15.43 62.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.731 0.412 . . . . 0.0 111.645 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -87.15 -10.41 52.78 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 123.674 0.789 . . . . 0.0 111.218 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -140.98 33.62 1.75 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 122.734 0.414 . . . . 0.0 111.398 -172.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 p80 49.19 35.09 6.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 20.6 m95 57.32 38.68 28.64 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.245 1.418 . . . . 0.0 112.724 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.57 119.3 31.37 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.044 -1.835 . . . . 0.0 106.044 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -74.44 -18.28 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 119.024 -1.07 . . . . 0.0 111.734 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -84.87 -42.2 15.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -176.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -68.88 -38.86 79.94 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.803 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.03 -26.67 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.428 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -76.35 -33.44 58.96 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 118.025 0.375 . . . . 0.0 110.341 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -72.72 -34.12 66.89 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.147 0.43 . . . . 0.0 109.953 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.82 -40.23 72.58 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.07 -0.394 . . . . 0.0 110.241 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.41 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.1 t80 -66.24 -39.43 89.54 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.689 -0.632 . . . . 0.0 111.245 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -75.81 -6.52 51.1 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 122.219 -0.3 . . . . 0.0 110.674 174.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 CA--C 1.53 0.178 0 CA-C-O 120.609 0.242 . . . . 0.0 110.878 175.316 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.536 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.536 0 CA-C-O 121.071 0.462 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.5 Cg_exo -67.62 -29.87 35.8 Favored 'Trans proline' 0 N--CA 1.453 -0.853 1 C-N-CA 125.519 4.146 . . . . 0.0 111.778 -173.767 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 31.5 mt-10 -91.96 -32.93 15.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.356 176.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -76.71 -11.8 59.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.018 0.527 . . . . 0.0 111.16 -174.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.47 -13.18 52.75 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.96 -45.39 3.63 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 170.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.2 mt -61.17 -50.33 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.487 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.0 mt-10 -72.63 -20.74 61.22 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.967 -174.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -83.05 -32.99 26.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -80.09 -59.06 2.86 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.247 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.487 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -56.92 -27.35 60.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.212 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.1 m -82.29 -27.09 32.55 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.076 0.853 . . . . 0.0 112.076 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.7 tp -88.47 -21.03 24.41 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.198 0.599 . . . . 0.0 111.923 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -110.34 -3.2 16.3 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 123.168 0.587 . . . . 0.0 110.89 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt 63.58 12.94 6.87 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 123.647 0.592 . . . . 0.0 111.72 168.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.8 p -88.89 -165.59 1.38 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.911 0.884 . . . . 0.0 110.427 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -97.05 146.62 31.62 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 85.3 Cg_exo -53.29 -18.61 10.94 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.444 2.763 . . . . 0.0 114.257 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -82.77 -13.77 55.68 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.8 0.727 . . . . 0.0 111.846 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -92.05 -36.36 7.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -54.18 -56.58 16.83 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.9 ptp180 -57.45 -39.28 75.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.803 -174.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -73.74 -14.33 61.11 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.034 0.834 . . . . 0.0 112.787 -178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.405 ' CD2' ' NH2' ' A' ' 38' ' ' ARG . 11.0 m-85 -98.44 -26.11 14.57 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 118.762 0.71 . . . . 0.0 109.857 172.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.28 -33.93 61.29 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 70.5 mt-30 -67.35 -12.13 59.42 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.166 0.586 . . . . 0.0 111.511 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.405 ' NH2' ' CD2' ' A' ' 35' ' ' TYR . 33.2 mtm-85 -97.79 -10.39 24.89 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 122.873 0.469 . . . . 0.0 111.463 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -131.03 27.88 4.83 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.368 0.667 . . . . 0.0 110.872 -174.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 53.59 31.7 13.0 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.702 0.801 . . . . 0.0 112.125 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.472 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 16.9 m95 58.77 31.53 21.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.347 1.059 . . . . 0.0 112.378 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.53 110.69 18.87 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -70.42 -15.7 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 119.378 -0.929 . . . . 0.0 111.867 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -85.07 -42.29 14.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.74 -39.91 80.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.646 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.8 -26.03 60.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.757 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.9 -34.84 64.55 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -72.98 -27.21 61.67 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -82.63 -12.18 57.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.746 0.419 . . . . 0.0 111.761 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -98.46 -36.15 10.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.76 1.224 . . . . 0.0 110.926 172.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -71.57 -10.09 59.23 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 172.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.922 0.391 . . . . 0.0 110.434 175.279 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -64.4 -25.58 63.56 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.215 3.277 . . . . 0.0 110.063 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -90.52 -45.34 9.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.388 -1.733 . . . . 0.0 109.914 177.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.75 -15.63 62.7 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.007 0.523 . . . . 0.0 110.894 -173.138 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.62 -13.53 60.06 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.95 -56.74 2.33 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.077 170.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -51.91 -51.21 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 C-N-CA 123.395 0.678 . . . . 0.0 112.411 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.2 mt-10 -75.55 -20.32 58.74 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 118.153 -1.419 . . . . 0.0 111.127 -173.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.6 t -80.89 -32.35 34.84 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -80.96 -59.22 2.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.6 1.16 . . . . 0.0 109.307 -174.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.48 -28.61 60.21 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.505 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.2 m -81.93 -26.09 34.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.836 0.744 . . . . 0.0 111.776 175.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.75 -23.3 25.52 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.13 0.572 . . . . 0.0 111.87 178.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.9 p -107.6 -3.98 18.76 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.066 0.546 . . . . 0.0 110.791 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt 63.67 12.27 6.44 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.658 0.383 . . . . 0.0 111.473 169.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -94.44 -167.89 1.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.401 1.08 . . . . 0.0 110.792 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -88.17 142.09 31.53 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.034 0.934 . . . . 0.0 109.423 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -64.98 -17.05 58.34 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.276 2.651 . . . . 0.0 113.187 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 11.2 mmpt? -83.22 -9.92 58.87 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.394 0.543 . . . . 0.0 110.329 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -91.86 -35.2 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -57.49 -46.54 83.6 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 76.4 ttt-85 -47.52 -58.45 4.2 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 125.316 1.446 . . . . 0.0 110.052 175.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -68.78 -11.74 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -175.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 19.5 m-85 -102.77 -17.01 15.78 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.398 0.999 . . . . 0.0 109.714 174.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.9 mt -80.07 -35.69 36.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 25.6 mt-30 -65.96 -17.09 64.44 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.761 0.425 . . . . 0.0 111.389 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.3 mtp85 -83.45 -9.52 58.95 Favored 'General case' 0 C--O 1.23 0.042 0 C-N-CA 123.502 0.721 . . . . 0.0 111.062 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -142.01 27.7 1.78 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 54.41 31.34 14.4 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.36 0.664 . . . . 0.0 112.402 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 14.9 m95 60.16 34.5 21.13 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.795 1.238 . . . . 0.0 112.621 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.98 116.91 25.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 172.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -73.29 -17.6 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 118.913 -1.115 . . . . 0.0 111.677 -169.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.59 -42.32 15.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.84 -39.57 79.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.595 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.4 -27.06 62.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.607 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.8 mt -76.08 -33.88 59.53 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.259 0.481 . . . . 0.0 110.508 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -71.66 -35.34 70.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -70.97 -41.38 71.12 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 59.7 t80 -65.24 -39.1 92.26 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 121.635 -0.666 . . . . 0.0 111.182 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -77.14 -4.95 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.389 -0.195 . . . . 0.0 110.782 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.529 0.168 0 CA-C-N 117.708 0.231 . . . . 0.0 111.001 174.86 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.539 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.936 0.398 . . . . 0.0 110.106 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.5 Cg_exo -67.88 -30.46 33.19 Favored 'Trans proline' 0 N--CA 1.455 -0.785 1 C-N-CA 125.51 4.14 . . . . 0.0 111.166 -175.159 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -88.66 -38.54 14.71 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.477 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 -8.22 57.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -171.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.52 -12.87 53.38 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.88 -49.82 2.85 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.304 170.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.07 -52.47 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 CA-C-N 118.648 0.658 . . . . 0.0 112.282 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.563 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.55 -20.62 59.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 118.387 -1.325 . . . . 0.0 110.803 -172.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 t -80.89 -33.46 34.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -78.25 -63.42 1.4 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.485 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -52.67 -27.65 18.25 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.304 1.041 . . . . 0.0 112.917 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m -84.2 -28.05 27.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.277 0.944 . . . . 0.0 112.039 174.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.82 -18.97 35.82 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.028 0.531 . . . . 0.0 111.473 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.2 p -116.83 -1.87 11.95 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.36 12.33 6.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.542 0.526 . . . . 0.0 112.357 169.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.0 p -86.03 -175.37 5.53 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.956 0.503 . . . . 0.0 110.886 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.446 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.3 t70 -83.55 145.82 48.72 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 53.4 Cg_exo -57.81 -9.29 5.52 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.796 2.997 . . . . 0.0 114.749 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -99.25 -12.71 20.14 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.597 0.635 . . . . 0.0 111.473 177.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -89.47 -38.13 10.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.7 p -54.36 -49.5 69.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.083 0.944 . . . . 0.0 108.601 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 20.3 ttt85 -53.74 -52.36 60.39 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.982 2.513 . . . . 0.0 111.618 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -67.76 -18.01 64.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.694 0.679 . . . . 0.0 112.456 -177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.439 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 22.4 m-85 -95.05 -20.41 19.35 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.041 0.837 . . . . 0.0 110.25 174.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.5 mp -75.36 -39.15 59.59 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.1 mt-30 -64.45 -18.72 65.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.169 0.588 . . . . 0.0 111.717 178.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.5 mtp85 -81.12 -9.44 59.81 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.373 0.669 . . . . 0.0 111.174 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -140.52 27.55 2.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.634 0.374 . . . . 0.0 111.839 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 53.9 33.39 17.12 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.549 0.74 . . . . 0.0 112.116 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.7 m95 59.87 31.6 20.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.519 1.128 . . . . 0.0 112.67 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -86.6 112.08 21.25 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tt -69.75 -16.97 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.912 -170.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -85.26 -42.75 14.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -177.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.55 -38.88 81.18 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.6 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.66 -26.94 61.82 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.6 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -74.22 -34.31 63.65 Favored 'General case' 0 C--N 1.338 0.078 0 CA-C-N 118.222 0.465 . . . . 0.0 109.935 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -71.48 -35.79 70.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.154 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -70.93 -42.09 70.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.3 t80 -66.38 -38.65 88.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.574 -0.704 . . . . 0.0 111.424 177.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -76.78 -5.68 49.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.555 0.161 . . . . 0.0 110.818 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 CA--C 1.529 0.154 0 CA-C-N 117.925 0.33 . . . . 0.0 111.215 175.374 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.275 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -63.52 -25.45 70.06 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.958 3.105 . . . . 0.0 110.009 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -90.73 -45.92 8.56 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 113.625 -1.625 . . . . 0.0 109.885 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.73 -16.19 62.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.171 0.588 . . . . 0.0 110.88 -172.473 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.42 -14.0 60.09 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.81 -54.55 2.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 123.644 0.59 . . . . 0.0 110.176 171.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 mt -52.78 -53.3 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-O 118.737 -0.649 . . . . 0.0 112.267 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.556 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.3 mt-10 -73.18 -21.26 60.72 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 118.088 -1.445 . . . . 0.0 111.072 -173.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.0 t -81.46 -29.6 33.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -85.34 -56.96 3.27 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.153 0.981 . . . . 0.0 109.542 -174.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.556 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -57.06 -27.43 61.69 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.293 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -83.6 -30.33 27.05 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 119.076 0.853 . . . . 0.0 111.533 174.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -81.4 -16.09 53.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.855 0.462 . . . . 0.0 111.325 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -120.11 -1.28 10.37 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.558 0.743 . . . . 0.0 111.705 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp 63.05 10.07 4.23 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.455 0.472 . . . . 0.0 112.242 169.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.5 p -89.33 -172.44 3.62 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.183 0.593 . . . . 0.0 110.925 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -86.94 145.19 37.96 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -55.22 -23.16 35.63 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.387 2.725 . . . . 0.0 113.864 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -83.97 -12.5 55.22 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.026 0.375 . . . . 0.0 111.127 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.7 t -86.48 -38.65 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.5 t -57.71 -47.1 83.32 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.479 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 74.1 ttt-85 -53.52 -23.88 11.76 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 125.072 1.349 . . . . 0.0 112.263 177.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -99.94 -11.04 21.0 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 120.419 1.463 . . . . 0.0 112.315 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.432 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 40.3 m-85 -102.0 -7.36 22.43 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.082 0.401 . . . . 0.0 109.974 171.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.435 HD23 ' CE3' ' A' ' 41' ' ' TRP . 4.7 mp -86.9 -41.98 13.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.026 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 30.9 mt-30 -64.74 -10.43 27.45 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -76.81 -21.85 54.49 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.719 0.808 . . . . 0.0 111.372 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -144.45 35.73 1.19 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.137 0.575 . . . . 0.0 112.399 -171.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 57.55 36.16 26.56 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CE3' HD23 ' A' ' 36' ' ' LEU . 17.0 m95 60.13 46.0 11.09 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.009 0.923 . . . . 0.0 112.602 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -98.68 111.05 23.55 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 175.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 tt -67.06 -17.83 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 120.237 -0.585 . . . . 0.0 112.15 -171.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -86.68 -44.02 12.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.347 -0.845 . . . . 0.0 108.896 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.4 m-30 -66.45 -38.54 87.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.537 177.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.37 -30.74 68.8 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.265 0.626 . . . . 0.0 112.004 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -72.73 -31.54 65.04 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.777 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -74.6 -36.77 62.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.16 -44.37 72.4 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 117.803 0.274 . . . . 0.0 110.609 -179.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.432 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 30.3 t80 -68.85 -36.63 78.37 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.694 -0.629 . . . . 0.0 111.506 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -74.88 -7.92 54.94 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.061 -0.399 . . . . 0.0 110.282 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 122.084 0.154 . . . . 0.0 111.15 174.968 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.533 0.291 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -63.76 -26.53 68.07 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 124.003 3.135 . . . . 0.0 109.917 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.424 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 52.4 mt-10 -89.07 -47.51 8.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.169 -1.832 . . . . 0.0 109.892 177.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.593 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.25 -16.27 63.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.753 0.658 . . . . 0.0 111.157 -172.411 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.9 -12.34 59.94 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.95 -51.64 2.77 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.617 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 mt -54.84 -53.15 35.84 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 118.713 -0.661 . . . . 0.0 111.628 -178.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.5 mt-10 -73.93 -20.78 60.28 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.203 -172.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -82.3 -28.62 31.6 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -84.15 -63.81 1.28 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.925 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -49.63 -28.23 5.58 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.341 1.057 . . . . 0.0 112.733 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.3 p -79.51 -39.55 31.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.27 0.941 . . . . 0.0 111.803 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.0 tp -78.19 -18.74 55.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.471 0.709 . . . . 0.0 111.983 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.0 p -111.13 -3.04 15.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.273 0.629 . . . . 0.0 110.801 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 63.82 11.59 6.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.543 0.527 . . . . 0.0 111.935 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -94.49 -174.44 3.33 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.941 0.497 . . . . 0.0 111.606 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -80.94 151.41 70.48 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.098 0.559 . . . . 0.0 111.055 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.88 -2.18 9.82 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.983 3.122 . . . . 0.0 112.217 -177.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -102.37 -7.8 21.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.2 0.6 . . . . 0.0 111.07 175.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.3 t -102.54 -35.28 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.097 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -51.18 -47.81 62.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 122.656 1.217 . . . . 0.0 108.816 172.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -54.82 -52.32 63.07 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 128.757 2.823 . . . . 0.0 112.058 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.05 -14.35 61.84 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.59 0.632 . . . . 0.0 112.474 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.4 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 32.1 m-85 -98.33 -5.3 33.15 Favored 'General case' 0 C--N 1.337 0.037 0 C-N-CA 123.255 0.622 . . . . 0.0 110.233 172.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.0 mp -93.31 -48.15 6.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 173.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -55.86 -25.1 40.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.956 0.502 . . . . 0.0 110.89 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.286 20.3 ttm180 -65.1 -20.64 66.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.988 2.515 . . . . 0.0 113.64 -178.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -144.56 29.95 1.24 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.975 0.91 . . . . 0.0 110.217 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 61.82 36.6 15.99 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.061 0.545 . . . . 0.0 112.059 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.424 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.8 m95 61.05 42.71 12.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.854 1.261 . . . . 0.0 111.884 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -95.35 112.48 24.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.93 -16.71 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.886 -171.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.77 -43.28 12.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -67.12 -39.23 86.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.601 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.4 -31.17 70.33 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.808 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.39 -28.2 60.99 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.906 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.85 -38.4 53.83 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.159 176.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.36 -41.75 66.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.916 -0.49 . . . . 0.0 110.995 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.4 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 43.8 t80 -68.3 -36.66 79.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 121.581 -0.699 . . . . 0.0 111.375 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -74.97 -9.16 58.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.531 0.239 0 CA-C-N 117.61 0.187 . . . . 0.0 111.018 174.645 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.557 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.765 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -74.15 -27.37 11.81 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.307 2.672 . . . . 0.0 110.513 172.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.407 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 47.5 mt-10 -89.14 -46.37 8.87 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.837 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.9 OUTLIER -70.46 -13.94 62.33 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 125.022 1.329 . . . . 0.0 110.223 -172.039 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -81.43 -12.31 58.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.19 -50.5 2.9 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.281 169.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.7 mt -56.06 -51.94 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HA ' HG22 ' A' ' 22' ' ' THR . 20.0 mt-10 -74.99 -19.64 60.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 118.514 -1.274 . . . . 0.0 110.775 -173.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -82.1 -32.31 30.28 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -81.58 -56.26 4.13 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.783 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.547 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -58.27 -28.69 65.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.409 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -82.92 -26.32 31.59 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 118.856 0.753 . . . . 0.0 111.629 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.4 tp -86.49 -18.65 31.08 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.097 0.559 . . . . 0.0 111.686 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -111.28 -4.17 15.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.149 0.58 . . . . 0.0 111.228 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt 63.4 10.35 4.73 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.558 0.536 . . . . 0.0 111.642 169.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 t -95.04 -170.73 2.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.967 0.907 . . . . 0.0 110.569 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.71 144.65 42.77 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.149 0.58 . . . . 0.0 110.454 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -56.06 -24.45 49.17 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.652 2.901 . . . . 0.0 114.098 -177.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -81.51 -18.8 43.81 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 117.901 0.319 . . . . 0.0 110.481 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -81.99 -34.62 12.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.1 t -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 57.0 ttt85 -47.63 -54.88 10.64 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.541 1.136 . . . . 0.0 110.767 177.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -66.59 -18.79 65.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -176.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -94.58 -21.75 18.64 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.462 1.028 . . . . 0.0 109.976 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 mp -74.18 -37.2 64.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 78.0 mt-30 -66.84 -16.67 64.45 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.124 -0.36 . . . . 0.0 111.801 177.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -84.13 -9.55 58.49 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.183 0.593 . . . . 0.0 110.912 177.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -141.45 26.84 1.93 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.796 0.439 . . . . 0.0 111.706 -171.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 53.62 33.01 15.53 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.605 0.762 . . . . 0.0 112.533 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.407 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 16.2 m95 60.44 33.6 20.63 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.533 1.133 . . . . 0.0 112.379 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -88.82 110.77 21.32 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 172.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.5 tt -69.46 -16.58 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 C-N-CA 119.758 -0.777 . . . . 0.0 112.23 -171.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -85.04 -42.79 14.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.7 -39.74 80.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.815 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.9 -27.66 62.01 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.68 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.1 mt -75.63 -33.59 60.51 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -70.08 -37.46 75.45 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -70.94 -32.14 68.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.298 -0.251 . . . . 0.0 110.713 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -80.6 -35.73 33.73 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.479 -0.763 . . . . 0.0 111.758 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.34 -12.75 45.3 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 175.272 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -66.67 -25.66 46.66 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 124.21 3.274 . . . . 0.0 110.039 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 41.4 mt-10 -90.93 -47.35 7.64 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 113.41 -1.723 . . . . 0.0 109.873 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.618 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.12 -14.06 62.48 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.42 0.688 . . . . 0.0 110.828 -173.277 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.25 -14.61 59.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.77 -56.68 2.33 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.052 170.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.1 mt -52.24 -50.08 38.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.57 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.9 mt-10 -76.16 -20.31 57.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 118.272 -1.371 . . . . 0.0 110.695 -174.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -82.41 -26.97 32.3 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -87.1 -52.7 5.28 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -174.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.57 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.9 t -58.87 -30.15 67.52 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.195 178.228 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -84.23 -28.54 27.19 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.834 0.743 . . . . 0.0 111.992 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.4 tt -84.33 -22.57 30.57 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.094 -0.379 . . . . 0.0 111.209 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.3 p -112.59 -3.23 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.298 0.639 . . . . 0.0 111.77 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp 63.89 9.24 4.37 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.481 0.488 . . . . 0.0 112.032 169.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 t -90.19 -168.86 2.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.991 0.916 . . . . 0.0 109.934 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -86.6 144.38 37.44 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 122.893 0.477 . . . . 0.0 110.365 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -56.97 -26.55 68.67 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.445 2.763 . . . . 0.0 113.498 -177.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -79.51 -18.89 50.95 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.15 0.432 . . . . 0.0 110.797 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.0 t -82.81 -33.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.0 m -60.2 -46.77 88.61 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.5 ttt-85 -60.47 -37.54 81.33 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 125.479 1.512 . . . . 0.0 112.088 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -86.19 -8.2 57.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 119.519 1.054 . . . . 0.0 113.114 -175.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.407 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 14.8 m-85 -99.73 -22.64 15.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 24.7 mt -75.47 -34.85 60.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.458 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 50.6 mt-30 -68.33 -11.89 60.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -94.98 -5.56 44.37 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.796 0.438 . . . . 0.0 110.955 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -136.84 27.26 2.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.528 0.731 . . . . 0.0 111.408 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 54.39 31.32 14.32 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.661 0.784 . . . . 0.0 112.35 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.1 m95 58.97 31.85 21.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.532 1.133 . . . . 0.0 112.649 -178.331 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.93 117.41 23.91 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 173.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tt -73.62 -17.1 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 118.802 -1.159 . . . . 0.0 112.013 -169.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -85.68 -41.89 14.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.83 -40.15 79.62 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.683 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.14 -27.78 62.83 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.541 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.6 mt -75.53 -31.63 60.17 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.361 177.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -72.94 -31.7 64.77 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.069 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -71.94 -34.79 69.31 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 56.5 t80 -71.65 -44.84 63.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.796 -0.565 . . . . 0.0 111.268 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -64.89 -16.28 63.04 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 117.814 0.279 . . . . 0.0 110.39 176.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.5 t70 . . . . . 0 N--CA 1.455 -0.191 0 C-N-CA 122.636 0.374 . . . . 0.0 110.777 177.562 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.489 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.1 t . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -63.5 -25.98 70.13 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.805 3.004 . . . . 0.0 110.043 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 32.9 mt-10 -91.36 -46.37 8.06 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.796 -1.547 . . . . 0.0 109.773 177.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 8.8 mm100 -70.37 -12.5 61.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 123.343 0.402 . . . . 0.0 111.796 -174.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -79.36 -15.18 58.32 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.25 -51.56 2.86 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.794 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.6 mt -56.16 -48.93 78.51 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.948 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' HG22 ' A' ' 22' ' ' THR . 16.7 mt-10 -75.67 -21.25 57.81 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.374 -175.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 t -81.3 -34.68 31.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -76.3 -62.33 1.65 Allowed 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.111 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.535 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -54.44 -29.66 50.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.867 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -81.2 -25.64 36.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 119.056 0.844 . . . . 0.0 112.073 175.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.6 tp -89.97 -22.53 21.89 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.927 0.491 . . . . 0.0 112.077 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.6 p -109.02 -3.75 17.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.238 0.615 . . . . 0.0 111.056 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt 63.51 13.5 7.25 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.707 0.403 . . . . 0.0 111.854 168.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.7 p -87.38 -169.5 2.64 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.627 0.771 . . . . 0.0 110.65 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.458 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.5 t70 -88.15 144.39 34.29 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -59.29 -7.93 5.9 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.995 3.13 . . . . 0.0 114.683 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.552 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 10.7 mmpt? -97.95 -10.76 23.98 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.657 0.662 . . . . 0.0 111.208 176.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -91.53 -38.72 10.86 Favored 'Isoleucine or valine' 0 C--N 1.337 0.06 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -53.4 -44.03 68.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 122.324 1.059 . . . . 0.0 109.157 174.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 62.8 ttt-85 -63.85 -33.14 75.02 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.101 2.56 . . . . 0.0 112.066 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -88.73 -9.87 50.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 119.224 0.92 . . . . 0.0 112.522 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -97.58 -24.64 15.46 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.2 -35.56 63.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.2 mt-30 -67.38 -12.81 61.15 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -94.63 -7.6 40.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.981 0.513 . . . . 0.0 111.348 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -133.41 27.18 4.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.291 0.636 . . . . 0.0 111.144 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 53.21 31.16 11.06 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.668 0.787 . . . . 0.0 112.223 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.7 m95 58.43 33.21 22.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.593 1.157 . . . . 0.0 112.275 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.07 116.01 22.65 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.21 -16.96 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.929 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.04 -41.18 16.03 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -69.74 -40.37 76.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.679 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.48 -27.68 62.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 122.703 0.401 . . . . 0.0 111.364 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.68 -34.31 64.83 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -73.11 -30.52 63.7 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -17.52 59.38 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 122.579 0.352 . . . . 0.0 111.759 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.28 -36.17 11.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.477 1.111 . . . . 0.0 111.621 174.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -75.05 -5.13 42.43 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.239 -0.288 . . . . 0.0 110.372 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 CA--C 1.528 0.122 0 C-N-CA 122.677 0.391 . . . . 0.0 111.122 175.252 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.471 0 CA-C-O 121.259 0.552 . . . . 0.0 110.726 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 90.3 Cg_endo -83.43 -21.11 4.53 Favored 'Trans proline' 0 N--CA 1.451 -1.0 1 C-N-CA 125.534 4.156 . . . . 0.0 109.805 -168.142 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.509 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 20.9 mt-10 -98.81 -28.21 13.59 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.312 175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.403 ' HG2' ' HB3' ' A' ' 12' ' ' SER . 4.1 mm100 -79.07 -14.38 59.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -175.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -81.05 -11.18 59.57 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' PHE . . . -112.67 -49.16 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.072 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.42 -47.93 88.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 CA-C-N 118.843 0.747 . . . . 0.0 111.77 -178.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.3 mt-10 -75.14 -20.3 59.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.827 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -84.41 -28.9 26.59 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 17' ' ' ALA . 27.7 t80 -83.66 -54.12 5.16 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -175.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.3 t -56.71 -30.37 63.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.424 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.8 m -83.4 -26.95 29.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 0.77 . . . . 0.0 111.811 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.4 tp -87.24 -16.41 35.32 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.0 p -119.95 -1.49 10.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 122.806 0.442 . . . . 0.0 111.721 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.96 10.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 169.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.04 -168.58 2.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.159 0.584 . . . . 0.0 110.355 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -87.79 143.88 34.2 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 77.6 Cg_exo -55.61 -24.06 43.27 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.303 2.669 . . . . 0.0 113.71 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -78.68 -19.25 52.93 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 121.867 -0.52 . . . . 0.0 110.738 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -82.66 -32.67 10.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 175.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.2 m -62.5 -47.35 84.35 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.481 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 46.3 ttt85 -57.5 -39.18 75.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 111.948 178.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -81.26 -19.06 43.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 119.527 1.058 . . . . 0.0 113.234 -177.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.63 -24.61 19.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 119.258 0.935 . . . . 0.0 109.861 176.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mp -70.19 -36.8 74.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.7 mt-30 -67.57 -12.61 60.78 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -93.8 -7.06 44.49 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.169 0.588 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -134.47 25.51 3.77 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.252 0.621 . . . . 0.0 111.337 -175.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 54.08 31.62 14.12 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.363 0.665 . . . . 0.0 111.729 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.509 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 14.5 m95 59.24 32.84 22.31 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.816 1.246 . . . . 0.0 112.416 -177.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.3 110.76 19.31 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.4 tt -69.45 -16.61 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.031 -170.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.62 -42.57 14.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.13 -39.38 82.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.488 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.83 61.01 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.598 -177.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.1 mt -73.18 -33.35 65.38 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -72.09 -32.91 67.46 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -70.02 -37.68 75.68 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.344 -0.223 . . . . 0.0 110.457 178.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -73.26 -41.04 64.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.845 -0.534 . . . . 0.0 111.657 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.12 -9.48 55.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.093 0.406 . . . . 0.0 110.37 175.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.7 t70 . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 122.838 0.455 . . . . 0.0 110.662 175.292 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.54 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.134 0.492 . . . . 0.0 110.877 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.54 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.9 Cg_exo -66.98 -30.54 39.13 Favored 'Trans proline' 0 N--CA 1.456 -0.716 1 C-N-CA 125.479 4.119 . . . . 0.0 111.898 -173.866 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.468 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 57.7 mt-10 -92.7 -35.27 13.57 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.349 176.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -75.14 -8.44 56.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.13 0.572 . . . . 0.0 111.399 -175.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.95 -14.68 43.96 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.02 -47.7 3.39 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.768 171.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.6 mt -58.16 -51.81 66.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.706 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.477 ' HA ' HG22 ' A' ' 22' ' ' THR . 23.5 mt-10 -70.8 -23.39 62.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 118.779 -1.168 . . . . 0.0 111.164 -175.001 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.2 t -81.04 -34.29 32.92 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -79.12 -61.3 2.06 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.403 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.477 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.5 t -53.75 -28.73 36.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.079 0.951 . . . . 0.0 112.618 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.5 m -83.31 -28.08 29.32 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 119.078 0.854 . . . . 0.0 111.812 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 tp -84.28 -16.7 42.18 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.055 0.542 . . . . 0.0 111.781 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.4 p -118.51 -2.04 11.1 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 122.875 0.47 . . . . 0.0 111.752 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp 63.23 10.4 4.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 169.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -89.17 -174.55 4.47 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.812 0.445 . . . . 0.0 110.745 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -80.92 150.46 69.01 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 122.271 0.228 . . . . 0.0 110.89 178.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.4 -22.55 50.71 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -86.72 -10.08 54.5 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -97.85 -36.34 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.8 p -54.9 -36.97 65.76 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 122.341 1.067 . . . . 0.0 109.411 174.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 31.4 ttt85 -67.73 -54.16 21.61 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 127.909 2.483 . . . . 0.0 110.942 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -67.29 -10.0 46.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 28.5 m-85 -105.24 -9.3 17.77 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.65 0.659 . . . . 0.0 110.442 174.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -86.44 -38.77 17.0 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.411 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 81.3 mt-30 -63.7 -16.26 60.61 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.334 0.654 . . . . 0.0 112.761 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -78.32 -15.86 58.3 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.037 0.535 . . . . 0.0 111.605 -178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -143.67 36.52 1.31 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.746 0.419 . . . . 0.0 111.812 -173.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 57.66 33.34 23.11 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 13.9 m95 60.52 39.74 17.77 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.323 1.049 . . . . 0.0 112.306 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -89.6 111.18 22.05 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 174.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -68.19 -16.59 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.932 -169.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.17 -42.33 13.93 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.71 -41.29 83.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.817 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.83 74.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.748 0.819 . . . . 0.0 111.63 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.07 -33.49 63.69 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.148 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.8 -36.7 65.03 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.058 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.64 -43.52 76.14 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.8 t80 -64.06 -41.3 97.4 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.954 -0.466 . . . . 0.0 111.27 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -72.06 -4.07 26.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.171 0.189 . . . . 0.0 111.031 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.533 0.294 0 O-C-N 122.401 -0.187 . . . . 0.0 111.343 173.598 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -62.09 -25.72 77.59 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.134 3.222 . . . . 0.0 109.69 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.445 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 44.9 mt-10 -90.15 -43.96 10.1 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.877 177.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.576 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -73.24 -15.75 61.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.644 0.59 . . . . 0.0 110.926 -172.037 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -76.47 -13.29 60.11 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.07 -54.56 2.6 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.094 170.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.409 ' O ' HG22 ' A' ' 22' ' ' THR . 11.3 mt -53.44 -52.26 33.96 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.58 0 CA-C-O 118.854 -0.593 . . . . 0.0 112.181 -178.033 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.551 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.7 mt-10 -74.07 -21.0 60.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.936 -173.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -80.18 -33.39 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -80.74 -59.51 2.65 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.207 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.551 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -55.62 -28.84 57.51 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.377 1.071 . . . . 0.0 112.323 179.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 m -82.05 -26.24 33.9 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.2 0.909 . . . . 0.0 111.898 174.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -86.87 -22.69 25.6 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.133 0.573 . . . . 0.0 112.051 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -109.0 -3.52 17.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 123.509 0.724 . . . . 0.0 110.864 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt 64.0 12.34 6.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.421 0.451 . . . . 0.0 112.121 168.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -90.02 -165.23 1.3 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.43 0.692 . . . . 0.0 111.041 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -92.7 145.01 29.54 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.16 0.584 . . . . 0.0 109.628 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.09 -25.59 46.15 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.423 2.749 . . . . 0.0 113.807 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.4 -11.73 59.66 Favored 'General case' 0 C--O 1.228 -0.071 0 CA-C-N 118.147 0.431 . . . . 0.0 111.203 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -90.74 -37.53 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.1 t -58.35 -44.67 88.85 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.6 ttt85 -48.87 -58.28 5.09 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 125.066 1.346 . . . . 0.0 110.603 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -68.18 -13.4 62.21 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 21.3 m-85 -100.97 -18.03 16.5 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.225 0.921 . . . . 0.0 110.118 175.319 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.2 mt -79.67 -35.28 39.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 80.4 mt-30 -66.05 -17.22 64.55 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.507 0.323 . . . . 0.0 111.461 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 -83.0 -10.18 58.91 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.385 0.674 . . . . 0.0 110.941 177.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -141.28 27.91 1.89 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.7 0.4 . . . . 0.0 111.864 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 54.32 31.25 14.0 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.518 0.727 . . . . 0.0 112.283 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.5 m95 60.09 34.31 21.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.52 1.128 . . . . 0.0 112.827 -178.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -86.91 116.39 24.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -72.74 -17.37 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 118.958 -1.097 . . . . 0.0 111.898 -170.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.79 -42.27 15.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -68.97 -39.76 79.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.63 63.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.432 -177.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 31.0 mt -75.71 -33.78 60.34 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 118.014 0.37 . . . . 0.0 110.191 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -71.79 -35.34 69.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.234 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.28 -42.86 71.55 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.707 0.289 . . . . 0.0 110.35 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.417 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 47.2 t80 -64.43 -38.49 91.21 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.548 -0.72 . . . . 0.0 111.408 177.428 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -77.57 -5.6 50.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.256 0.222 . . . . 0.0 110.841 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-N 117.777 0.262 . . . . 0.0 111.206 174.837 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.1 mt . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -64.44 121.07 13.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.418 175.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -90.1 29.57 1.21 Allowed 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.486 1.114 . . . . 0.0 111.085 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 52.26 18.78 0.95 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 125.64 1.576 . . . . 0.0 113.581 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -158.57 -38.75 0.06 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 122.53 0.332 . . . . 0.0 111.746 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.88 101.77 1.64 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 122.146 0.974 . . . . 0.0 110.498 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.9 OUTLIER -50.67 165.53 0.35 Allowed Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 113.69 -1.595 . . . . 0.0 111.495 170.405 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -64.29 -24.92 64.7 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.856 3.037 . . . . 0.0 109.927 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -92.55 -45.75 7.96 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.104 176.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.4 mm-40 -69.41 -13.49 62.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.727 -175.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.94 -14.47 59.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.73 -49.77 3.11 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 171.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt -58.6 -50.72 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.103 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.69 -20.97 61.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.571 -1.252 . . . . 0.0 111.201 -175.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.1 t -82.51 -32.16 28.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -81.33 -58.18 3.16 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.3 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -58.38 -26.88 63.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.031 0.932 . . . . 0.0 112.567 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.9 m -83.03 -28.49 29.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 118.711 0.687 . . . . 0.0 111.562 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.5 tp -83.95 -14.91 49.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.023 0.529 . . . . 0.0 111.757 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 p -121.91 -0.72 9.5 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.299 0.639 . . . . 0.0 111.927 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp 63.45 11.77 5.83 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 169.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.3 p -86.99 -172.57 4.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.979 0.512 . . . . 0.0 110.652 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.0 t70 -86.15 145.58 40.81 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 74.4 Cg_exo -54.6 -23.81 34.02 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.309 2.673 . . . . 0.0 113.845 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -83.85 -12.12 56.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.494 0.318 . . . . 0.0 111.277 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.04 -39.04 13.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.0 t -57.81 -44.68 86.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 174.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 75.9 ttt-85 -55.66 -23.88 30.67 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.912 1.285 . . . . 0.0 112.091 176.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -102.5 -6.51 22.81 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 120.052 1.296 . . . . 0.0 112.679 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -103.06 -16.22 15.84 Favored 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.8 mt -80.21 -39.58 28.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 40.8 mt-30 -68.0 -11.85 59.66 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 176.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -87.49 -12.78 44.96 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.631 0.372 . . . . 0.0 111.127 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -141.23 36.29 1.71 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.832 0.453 . . . . 0.0 111.37 -171.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 47.75 42.33 15.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 112.327 176.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.423 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 26.6 m95 50.86 35.77 13.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.524 1.53 . . . . 0.0 112.925 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -91.65 118.17 30.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tt -73.84 -18.16 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.805 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -84.75 -41.77 15.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -70.67 -36.94 73.58 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.81 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -26.83 61.36 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.523 0.329 . . . . 0.0 111.364 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.4 mt -76.63 -34.75 58.31 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 117.967 0.349 . . . . 0.0 110.392 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.04 -34.37 71.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.599 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.1 t70 -70.87 -40.38 72.31 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 122.2 -0.313 . . . . 0.0 110.274 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 28.2 t80 -68.95 -37.63 78.94 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.554 -0.716 . . . . 0.0 111.02 177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -73.19 -8.98 58.16 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 122.288 -0.257 . . . . 0.0 110.35 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -92.33 -11.94 33.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.24 0.216 . . . . 0.0 111.063 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -111.74 -38.83 4.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.126 0.57 . . . . 0.0 111.963 -175.818 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -105.56 -37.79 6.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 122.985 0.514 . . . . 0.0 111.85 -172.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -96.06 -15.37 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.021 0.528 . . . . 0.0 110.954 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.47 8.41 26.72 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.741 0.686 . . . . 0.0 113.239 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.7 t -128.23 26.7 5.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.788 0.794 . . . . 0.0 111.405 -177.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -66.88 -24.57 66.13 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -176.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 74.2 p -74.37 32.44 0.09 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -175.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -85.42 -0.2 54.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.891 0.853 . . . . 0.0 111.51 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -131.13 24.63 4.91 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.067 1.347 . . . . 0.0 111.006 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.1 t . . . . . 0 C--O 1.253 1.257 0 CA-C-O 117.097 -1.43 . . . . 0.0 110.104 -177.01 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.1 mm . . . . . 0 C--O 1.232 0.16 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -84.08 133.25 34.65 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.199 0.523 . . . . 0.0 110.26 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.85 57.35 1.81 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.744 1.217 . . . . 0.0 111.022 -174.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -72.39 45.15 0.13 Allowed 'General case' 0 C--N 1.335 -0.04 0 C-N-CA 126.204 1.802 . . . . 0.0 112.855 -174.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -143.5 -38.96 0.32 Allowed 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.765 0.426 . . . . 0.0 110.361 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -171.5 77.99 0.06 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 122.003 0.906 . . . . 0.0 109.685 177.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -60.58 -178.82 0.17 Allowed Pre-proline 0 N--CA 1.447 -0.578 0 C-N-CA 125.337 1.455 . . . . 0.0 110.195 171.131 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.8 Cg_exo -68.01 -28.89 34.73 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.338 4.025 . . . . 0.0 111.924 -174.935 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 30.6 mt-10 -93.29 -32.98 14.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.457 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -73.81 -15.8 61.17 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.157 0.583 . . . . 0.0 111.034 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -80.25 -13.67 59.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -107.5 -49.1 3.31 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.653 169.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.9 mt -60.21 -49.55 83.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.169 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.0 mt-10 -72.98 -21.14 60.89 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.123 -175.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -81.87 -33.31 30.63 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -80.48 -59.29 2.75 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.707 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -56.26 -29.1 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.436 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -82.01 -28.26 32.65 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.113 0.87 . . . . 0.0 111.819 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.9 tp -83.65 -17.54 41.15 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.741 0.416 . . . . 0.0 111.92 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.3 p -121.23 -0.33 9.94 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 122.999 0.519 . . . . 0.0 111.675 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.1 11.75 5.47 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 169.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.4 p -86.73 -169.7 2.75 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.222 0.609 . . . . 0.0 111.098 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 12.8 t70 -88.87 145.14 34.12 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 75.9 Cg_exo -54.07 -24.2 31.88 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.529 2.82 . . . . 0.0 114.136 -177.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 -16.97 45.78 Favored 'General case' 0 CA--C 1.522 -0.133 0 O-C-N 121.998 -0.439 . . . . 0.0 110.933 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.7 t -81.73 -35.63 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.0 t -60.52 -48.85 79.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.415 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.8 ttt85 -49.39 -57.75 6.37 Favored 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 124.727 1.211 . . . . 0.0 110.214 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -65.79 -13.95 60.45 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -102.19 -18.61 15.44 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.459 1.027 . . . . 0.0 109.981 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 34.0 mt -76.63 -34.95 58.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.0 mt-30 -67.14 -15.96 64.03 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.848 0.459 . . . . 0.0 111.719 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.2 mtp85 -87.86 -10.49 50.6 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.772 0.829 . . . . 0.0 111.094 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -141.03 34.47 1.74 Allowed 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.874 0.47 . . . . 0.0 111.374 -172.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 46.95 40.25 8.97 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.484 0.714 . . . . 0.0 112.183 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 23.4 m95 52.1 36.77 19.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 125.541 1.536 . . . . 0.0 113.153 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -92.15 120.25 32.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 172.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tt -74.61 -18.44 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 119.058 -1.057 . . . . 0.0 111.603 -170.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -84.4 -42.12 16.0 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -69.9 -37.94 76.16 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.915 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.52 -25.78 60.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 122.612 0.365 . . . . 0.0 111.386 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.9 mt -77.32 -33.41 55.56 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 118.009 0.368 . . . . 0.0 110.292 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -72.22 -34.65 68.5 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 122.033 -0.417 . . . . 0.0 110.06 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.595 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.6 t70 -70.14 -38.0 75.39 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 178.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -69.52 -41.81 75.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 121.72 -0.612 . . . . 0.0 111.491 177.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -69.54 -11.24 60.67 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 117.891 0.314 . . . . 0.0 110.328 176.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -89.9 -7.76 53.44 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.551 0.34 . . . . 0.0 110.865 175.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.595 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -115.53 -10.9 11.84 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -171.958 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -66.74 -20.3 65.93 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.532 0.606 . . . . 0.0 111.652 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.2 mm -74.16 -19.52 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 122.773 0.429 . . . . 0.0 110.463 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.55 -3.79 90.54 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 112.186 -0.365 . . . . 0.0 112.186 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.65 25.64 1.46 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.69 0.757 . . . . 0.0 110.422 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -78.99 -38.46 36.75 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.07 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.1 p -109.36 22.75 15.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.649 0.78 . . . . 0.0 110.033 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -106.35 2.79 26.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.742 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -103.49 13.7 32.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.991 1.316 . . . . 0.0 111.578 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 C--O 1.248 0.977 0 CA-C-O 117.134 -1.412 . . . . 0.0 110.695 -178.724 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.1 mm . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -63.76 120.92 12.78 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 171.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -80.79 35.82 0.37 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.687 1.195 . . . . 0.0 112.311 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -146.03 25.44 1.27 Allowed 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 -171.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -124.12 -16.76 6.4 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 53.15 60.13 3.96 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 122.249 1.023 . . . . 0.0 111.298 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.523 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -52.23 -179.23 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 126.193 1.797 . . . . 0.0 110.764 169.321 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.4 Cg_exo -66.48 -28.78 45.58 Favored 'Trans proline' 0 N--CA 1.456 -0.693 1 C-N-CA 125.632 4.221 . . . . 0.0 112.015 -173.34 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 59.2 mt-10 -95.2 -31.36 13.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.735 176.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -76.69 -12.22 59.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 123.497 0.498 . . . . 0.0 110.791 -175.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -82.52 -14.65 54.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.74 -49.25 3.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.977 169.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -60.31 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.88 -176.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.493 ' HA ' HG22 ' A' ' 22' ' ' THR . 22.5 mt-10 -72.44 -20.59 61.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.049 -175.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 t -83.35 -30.38 27.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -83.3 -59.19 2.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.377 1.071 . . . . 0.0 109.75 -176.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.11 -28.79 59.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.547 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.8 m -83.31 -29.63 28.17 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 119.244 0.929 . . . . 0.0 112.018 175.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -81.24 -16.56 52.31 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.587 0.355 . . . . 0.0 111.108 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -120.62 -1.95 9.99 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.148 0.579 . . . . 0.0 112.016 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp 62.81 10.36 4.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.0 p -89.98 -164.02 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.72 0.808 . . . . 0.0 111.503 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -91.11 144.92 30.66 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.733 0.813 . . . . 0.0 110.427 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.58 -22.27 27.63 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.137 2.558 . . . . 0.0 113.669 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -77.95 -31.35 50.84 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.7 p -83.75 -25.43 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.139 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.3 t -61.82 -51.27 68.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 47.3 ttt85 -51.4 -58.78 5.3 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 125.386 1.475 . . . . 0.0 110.585 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -63.06 -17.84 62.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -176.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 11.7 m-85 -100.42 -18.11 16.88 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.373 0.988 . . . . 0.0 110.245 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.4 mt -75.25 -34.81 61.43 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 172.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 81.4 mt-30 -67.55 -14.69 63.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.858 0.463 . . . . 0.0 111.55 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -90.18 -9.65 47.39 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 124.036 0.935 . . . . 0.0 111.355 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -140.28 33.74 1.89 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.909 0.484 . . . . 0.0 111.362 -172.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.8 p80 49.01 35.54 7.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.347 1.059 . . . . 0.0 112.489 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.477 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 21.0 m95 56.06 38.26 29.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.681 1.593 . . . . 0.0 112.416 -178.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -88.99 120.12 30.12 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 171.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -75.14 -17.83 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 118.757 -1.177 . . . . 0.0 111.775 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.11 -41.0 16.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -176.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.7 -38.41 73.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.024 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.67 -26.54 61.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.487 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.1 mt -76.63 -35.07 58.25 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.01 0.368 . . . . 0.0 110.162 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.6 -36.3 70.79 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.588 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 36.0 t70 -69.4 -40.67 77.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.426 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 64.3 t80 -68.83 -41.22 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.767 -0.583 . . . . 0.0 111.274 177.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -69.53 -8.32 46.11 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 117.651 0.205 . . . . 0.0 110.641 175.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -93.46 -6.64 46.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.179 0.192 . . . . 0.0 110.943 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.588 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -119.58 -33.51 4.03 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.348 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -77.76 -12.68 60.0 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.1 mm -65.09 -20.18 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 172.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.78 -5.01 86.2 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 123.155 0.407 . . . . 0.0 112.598 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.4 t -141.27 27.17 1.94 Allowed 'General case' 0 CA--C 1.528 0.116 0 CA-C-O 122.013 0.911 . . . . 0.0 110.156 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -77.57 -27.63 51.49 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.505 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 75.6 p -81.97 24.77 0.61 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.323 0.582 . . . . 0.0 110.937 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -114.43 4.89 15.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.729 177.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -95.76 12.81 28.66 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.561 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 C--O 1.252 1.205 0 C-N-CA 124.952 1.301 . . . . 0.0 110.449 -178.747 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.6 mt . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 121.906 0.86 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.423 ' C ' ' H ' ' A' ' 9' ' ' LYS . 75.3 mmtt -106.79 50.41 0.77 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.903 1.281 . . . . 0.0 109.999 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -71.58 24.99 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.296 1.438 . . . . 0.0 113.263 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 7' ' ' LYS . 53.5 mtmt 42.22 49.79 4.43 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.677 1.191 . . . . 0.0 111.892 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -113.98 -21.03 10.79 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.648 0.261 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 54.78 66.55 1.2 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.246 1.018 . . . . 0.0 110.554 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.506 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -52.58 179.24 0.05 OUTLIER Pre-proline 0 N--CA 1.449 -0.522 0 C-N-CA 126.701 2.0 . . . . 0.0 111.213 173.605 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.4 Cg_exo -67.43 -28.6 38.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.329 4.02 . . . . 0.0 111.602 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.473 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 29.3 mt-10 -92.84 -32.31 14.67 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.381 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -76.63 -13.65 60.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.752 0.421 . . . . 0.0 111.186 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -82.55 -12.34 57.82 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.17 -50.12 3.04 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 28.9 mt -57.82 -48.79 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 CA-C-O 118.736 -0.649 . . . . 0.0 112.295 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.505 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -74.08 -20.94 60.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.111 -175.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -82.83 -31.52 28.03 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -82.63 -56.29 3.94 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.27 -175.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.44 -28.05 64.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.144 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 m -81.34 -27.96 34.7 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.992 0.815 . . . . 0.0 111.983 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.5 tp -86.66 -20.01 28.42 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.071 0.548 . . . . 0.0 111.877 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.9 p -110.05 -4.03 16.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 123.319 0.648 . . . . 0.0 111.302 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.1 mmtt 63.03 11.56 5.25 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.509 0.505 . . . . 0.0 111.649 169.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.0 t -93.15 -164.31 1.16 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.222 1.009 . . . . 0.0 109.926 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -96.84 145.53 29.74 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 122.92 0.488 . . . . 0.0 110.303 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 73.7 Cg_exo -54.06 -17.83 12.09 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.592 2.862 . . . . 0.0 114.509 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -83.66 -10.09 58.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.893 0.77 . . . . 0.0 111.844 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -96.94 -36.48 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.8 t -52.62 -52.17 56.68 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.463 0.649 . . . . 0.0 109.763 177.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.6 ptp180 -59.89 -36.42 76.91 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.676 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -77.19 -11.56 59.83 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 119.373 0.988 . . . . 0.0 112.724 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 17.3 m-85 -102.32 -20.51 14.58 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 118.967 0.803 . . . . 0.0 109.682 172.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -76.23 -37.13 58.09 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 72.3 mt-30 -68.49 -12.99 62.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.237 0.615 . . . . 0.0 111.324 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -90.07 -10.55 44.34 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 123.695 0.798 . . . . 0.0 111.388 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -140.17 30.38 1.99 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.814 0.445 . . . . 0.0 111.593 -171.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 53.56 32.12 13.71 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 123.705 0.802 . . . . 0.0 112.584 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.473 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 18.8 m95 58.9 31.93 21.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.723 1.209 . . . . 0.0 112.776 -178.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -84.6 114.01 21.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 172.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -71.87 -16.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 C-N-CA 118.744 -1.182 . . . . 0.0 111.636 -169.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -84.85 -42.71 14.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -68.26 -40.39 81.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.662 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.89 63.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.567 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.85 -34.7 62.33 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.058 0.39 . . . . 0.0 110.273 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -72.29 -29.45 63.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -78.51 -17.54 56.08 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.122 0.569 . . . . 0.0 111.194 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 40.3 t80 -92.59 -37.87 12.21 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.668 1.187 . . . . 0.0 111.006 172.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -66.93 -14.42 62.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -78.82 -14.7 59.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.902 0.382 . . . . 0.0 111.19 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -100.88 -28.08 12.97 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.774 0.829 . . . . 0.0 109.908 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.19 -35.62 41.5 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 124.165 0.986 . . . . 0.0 110.747 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.1 mm -98.36 -25.22 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 122.927 0.491 . . . . 0.0 110.43 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.79 -5.62 30.2 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-O 119.387 -0.674 . . . . 0.0 114.169 175.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.8 t -149.23 33.39 0.73 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.285 1.042 . . . . 0.0 111.587 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -84.13 -46.41 11.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -172.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.3 t -152.66 29.04 0.54 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 122.192 0.996 . . . . 0.0 109.885 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -67.44 -0.65 3.88 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.044 -0.98 . . . . 0.0 113.327 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -88.28 13.89 10.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.989 1.316 . . . . 0.0 112.014 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--O 1.25 1.089 0 C-N-CA 125.027 1.331 . . . . 0.0 110.049 -179.365 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 122.221 1.01 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.4 ' C ' ' H ' ' A' ' 9' ' ' LYS . 75.5 mmtt -105.88 51.26 0.76 Allowed 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.636 1.574 . . . . 0.0 109.355 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.84 28.86 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.899 1.679 . . . . 0.0 113.517 -176.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 7' ' ' LYS . 63.3 mttp 44.96 45.04 8.51 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 124.802 1.241 . . . . 0.0 111.814 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -108.2 -15.19 14.55 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 123.231 0.612 . . . . 0.0 111.314 -175.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 43.9 76.8 0.08 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.268 1.427 . . . . 0.0 111.845 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 15' ' ' GLN . 1.3 t -38.65 163.44 0.05 OUTLIER Pre-proline 0 CA--C 1.528 0.114 0 C-N-CA 127.194 2.198 . . . . 0.0 113.643 171.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -62.31 -25.22 76.4 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.825 3.017 . . . . 0.0 109.899 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -91.54 -45.41 8.52 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 113.849 -1.523 . . . . 0.0 109.821 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HG2' ' HB3' ' A' ' 12' ' ' SER . 9.9 mm-40 -70.22 -12.87 61.89 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.827 0.451 . . . . 0.0 111.507 -174.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -80.58 -13.24 59.23 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.717 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.11 -46.83 3.17 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 171.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 mt -58.35 -51.97 64.79 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 118.898 -0.572 . . . . 0.0 111.377 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.5 mt-10 -72.11 -22.27 61.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.131 -174.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 t -81.37 -33.38 32.39 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -78.65 -61.66 1.94 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.552 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -54.15 -27.26 32.4 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 112.898 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.2 m -84.24 -28.35 27.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 118.947 0.794 . . . . 0.0 111.564 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.0 tp -83.84 -16.58 43.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.742 0.417 . . . . 0.0 111.685 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 p -118.7 -1.62 11.08 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.314 0.645 . . . . 0.0 111.607 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp 63.24 12.42 6.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.353 0.408 . . . . 0.0 112.036 169.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.45 -177.36 6.17 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 122.985 0.514 . . . . 0.0 111.104 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.43 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.1 t70 -80.93 146.52 59.58 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -58.31 -7.91 4.49 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.985 3.123 . . . . 0.0 114.756 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -101.64 -11.2 19.38 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 118.381 0.537 . . . . 0.0 111.359 177.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -89.78 -37.51 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.9 p -52.06 -51.39 57.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 108.673 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 27.7 ttt85 -51.55 -53.56 36.68 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 128.133 2.573 . . . . 0.0 111.354 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -68.61 -12.43 61.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.677 0.671 . . . . 0.0 112.789 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 27.6 m-85 -102.57 -7.93 21.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 118.727 0.694 . . . . 0.0 111.041 173.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -87.63 -37.99 16.3 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 80.1 mt-30 -64.69 -12.57 47.92 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -84.09 -15.46 47.28 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.36 0.664 . . . . 0.0 111.898 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -145.43 41.7 1.25 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.921 0.489 . . . . 0.0 110.969 -173.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 24.9 p80 51.29 37.76 19.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 176.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.408 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 17.0 m95 58.34 45.51 16.82 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.901 1.28 . . . . 0.0 112.066 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -96.65 113.5 25.07 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 175.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.33 -17.5 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.129 -170.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.3 -43.06 13.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -67.06 -40.04 86.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.617 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.65 72.47 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.485 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.9 mt -73.59 -31.32 63.52 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.122 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -75.75 -37.3 59.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.587 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 25.0 t70 -71.09 -40.15 71.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.078 -0.389 . . . . 0.0 110.612 -178.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 37.8 t80 -68.1 -40.85 82.52 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.709 -0.619 . . . . 0.0 111.555 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -71.33 -9.42 58.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.943 0.338 . . . . 0.0 110.17 176.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -91.65 -7.05 51.05 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.448 0.299 . . . . 0.0 111.14 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -116.82 -6.32 11.52 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -172.35 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.21 -12.82 55.34 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.277 0.489 . . . . 0.0 111.676 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.6 mm -70.86 -17.87 20.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 122.959 0.504 . . . . 0.0 109.831 178.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -79.17 -4.78 89.05 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 123.41 0.529 . . . . 0.0 112.363 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.2 t -138.83 27.54 2.43 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 121.886 0.85 . . . . 0.0 110.307 178.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.431 ' C ' ' H ' ' A' ' 60' ' ' ASP . 12.1 t80 -78.13 -25.66 47.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.79 0.836 . . . . 0.0 111.741 -175.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 68.7 p -79.82 25.04 0.37 Allowed 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.471 0.653 . . . . 0.0 111.133 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 58' ' ' PHE . 27.6 t70 -111.15 3.06 18.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.956 177.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -94.99 13.27 25.59 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.509 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.252 1.201 0 C-N-CA 124.774 1.23 . . . . 0.0 110.421 -178.615 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.4 mt . . . . . 0 CA--C 1.533 0.311 0 CA-C-O 121.39 0.614 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 9' ' ' LYS . 35.3 mmtp -98.59 46.11 1.0 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.946 0.898 . . . . 0.0 110.46 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -73.51 28.61 0.07 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.995 1.318 . . . . 0.0 112.249 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.438 ' H ' ' C ' ' A' ' 7' ' ' LYS . 95.7 mttt 45.82 37.56 3.6 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 125.16 1.384 . . . . 0.0 112.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.18 -40.88 0.17 Allowed 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.88 98.59 1.49 Allowed 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 121.958 0.885 . . . . 0.0 110.837 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -50.46 165.19 0.35 Allowed Pre-proline 0 C--N 1.332 -0.185 0 C-N-CA 125.866 1.666 . . . . 0.0 112.162 173.018 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.48 -25.37 70.36 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 123.986 3.124 . . . . 0.0 109.822 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -91.99 -45.88 8.1 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.154 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.0 mm-40 -69.93 -12.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.793 0.437 . . . . 0.0 111.666 -175.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -79.67 -14.63 58.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.688 177.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.54 -47.61 3.35 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.031 171.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -60.34 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.194 -178.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -73.31 -20.7 60.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 118.381 -1.328 . . . . 0.0 111.099 -175.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -81.55 -33.29 31.81 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -80.37 -58.15 3.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.681 -176.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.13 -27.44 63.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.06 0.944 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 m -83.04 -28.5 29.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.96 0.8 . . . . 0.0 111.347 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.1 tp -83.45 -14.98 51.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.7 0.4 . . . . 0.0 111.723 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.3 p -121.38 -0.66 9.79 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 123.232 0.613 . . . . 0.0 111.545 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.55 11.14 5.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 169.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.1 p -87.77 -172.27 3.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.107 0.563 . . . . 0.0 110.511 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -89.05 145.41 34.36 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 83.1 Cg_exo -51.79 -25.31 20.57 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.322 2.681 . . . . 0.0 114.483 -178.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -79.96 -17.45 52.94 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.959 0.799 . . . . 0.0 111.536 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.5 t -84.52 -35.41 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.0 t -59.18 -52.2 66.7 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.4 ttt85 -47.56 -55.9 8.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.975 1.31 . . . . 0.0 110.742 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -66.04 -20.38 66.16 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -90.57 -28.16 18.65 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-N 119.466 1.03 . . . . 0.0 109.603 175.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.64 -35.5 75.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.2 mt-30 -66.76 -15.23 63.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.2 mtm-85 -91.4 -7.52 50.51 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.589 0.356 . . . . 0.0 111.066 178.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -134.02 24.43 3.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.239 0.616 . . . . 0.0 111.227 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 53.52 31.65 12.75 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.373 0.669 . . . . 0.0 111.914 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.6 m95 60.44 34.64 20.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.723 1.209 . . . . 0.0 112.227 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -87.57 110.51 20.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tt -70.22 -16.04 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 119.436 -0.906 . . . . 0.0 111.938 -171.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -85.28 -42.41 14.66 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.67 -39.71 80.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.66 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.85 -26.89 60.81 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.89 -177.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.2 mt -75.04 -34.67 61.89 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -69.98 -32.49 70.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -71.81 -35.29 69.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -77.29 -37.83 51.94 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -63.85 -15.13 58.12 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 118.36 0.527 . . . . 0.0 109.681 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.469 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 34.8 t70 -86.34 -14.79 42.5 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.421 0.288 . . . . 0.0 111.577 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -94.17 -26.11 16.82 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.939 0.496 . . . . 0.0 110.313 -176.642 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -68.41 -18.71 64.51 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 42.0 mm -89.26 -17.24 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 122.838 0.455 . . . . 0.0 110.581 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.24 20.33 71.15 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 119.876 -0.402 . . . . 0.0 112.942 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -112.07 21.74 15.56 Favored 'General case' 0 CA--C 1.527 0.071 0 CA-C-N 117.676 0.738 . . . . 0.0 112.276 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -41.93 82.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.063 -172.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 33.1 p -86.84 31.74 0.69 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -121.46 4.76 10.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.838 0.828 . . . . 0.0 110.434 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -101.93 13.28 35.23 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.188 -1.369 . . . . 0.0 111.552 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.2 t . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.846 1.258 . . . . 0.0 109.677 -177.854 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -62.45 128.96 38.5 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.649 0.78 . . . . 0.0 109.054 174.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -100.32 19.64 16.25 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.365 0.666 . . . . 0.0 112.302 -177.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 45.23 34.34 1.41 Allowed 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.519 1.527 . . . . 0.0 113.2 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -152.82 -36.29 0.11 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 122.198 0.199 . . . . 0.0 111.137 -176.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -168.31 81.66 0.16 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 122.175 0.988 . . . . 0.0 108.468 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -59.28 -179.32 0.15 Allowed Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.06 1.744 . . . . 0.0 110.668 175.623 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.9 Cg_exo -67.33 -29.06 38.96 Favored 'Trans proline' 0 N--CA 1.454 -0.829 1 C-N-CA 125.703 4.268 . . . . 0.0 111.673 -174.17 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 53.7 mt-10 -94.54 -33.33 13.09 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.728 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -74.56 -13.44 60.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 122.773 0.429 . . . . 0.0 111.038 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.71 -14.79 56.1 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -50.37 3.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.769 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.7 mt -58.95 -49.72 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 118.734 -0.65 . . . . 0.0 112.236 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.503 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.7 mt-10 -73.56 -21.12 60.45 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.054 -175.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.74 -33.34 31.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -80.82 -58.43 3.1 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 124.462 1.105 . . . . 0.0 109.643 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.503 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -58.23 -27.72 64.21 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.635 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -82.1 -28.22 32.42 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.888 0.767 . . . . 0.0 111.464 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 48.0 tp -83.12 -15.68 49.77 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 111.79 177.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.1 p -118.85 -1.54 11.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 122.927 0.491 . . . . 0.0 111.59 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 63.23 11.21 5.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.717 0.407 . . . . 0.0 111.891 169.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -92.98 -173.02 3.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.877 0.871 . . . . 0.0 110.205 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -84.79 143.67 40.96 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 122.939 0.496 . . . . 0.0 110.503 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.53 -26.75 56.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.452 2.768 . . . . 0.0 113.896 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-N 118.149 0.431 . . . . 0.0 110.989 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -87.78 -36.94 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.8 t -58.08 -48.67 79.44 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 45.6 ttt85 -47.99 -55.62 9.61 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.322 1.449 . . . . 0.0 110.642 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -70.27 -13.41 62.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -97.67 -26.12 14.87 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 119.267 0.94 . . . . 0.0 109.269 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.42 -33.14 66.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 83.1 mt-30 -68.58 -14.34 62.95 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.053 -0.404 . . . . 0.0 111.707 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -92.87 -7.59 45.81 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 123.149 0.579 . . . . 0.0 111.127 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -134.29 25.56 3.83 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.418 0.687 . . . . 0.0 111.743 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 53.71 30.53 11.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.597 0.759 . . . . 0.0 112.279 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 15.9 m95 59.53 33.77 22.25 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.918 1.287 . . . . 0.0 112.643 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -85.22 116.18 23.43 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.55 -2.018 . . . . 0.0 105.55 172.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -74.18 -16.4 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 118.94 -1.104 . . . . 0.0 111.689 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -84.88 -40.74 16.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.65 -40.34 73.1 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.964 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.49 62.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.1 mt -75.74 -36.16 60.0 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.086 0.403 . . . . 0.0 110.116 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.07 -31.01 68.4 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -70.44 -35.92 73.66 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -76.58 -37.7 56.1 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 121.763 -0.586 . . . . 0.0 111.964 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -63.68 -15.44 58.39 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.46 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 36.0 t70 -86.65 -15.43 39.67 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 176.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.604 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -92.47 -24.71 18.72 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 123.022 0.529 . . . . 0.0 110.327 -176.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -67.29 -12.34 59.89 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.508 0.323 . . . . 0.0 111.835 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.4 mm -83.71 -11.83 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 123.45 0.7 . . . . 0.0 110.375 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -68.81 2.75 7.53 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.031 0.824 . . . . 0.0 113.893 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -98.76 23.02 9.26 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 117.813 0.807 . . . . 0.0 111.743 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -69.94 -23.94 63.28 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.28 0.632 . . . . 0.0 112.421 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 77.9 p -75.36 29.11 0.1 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.18 2.57 14.13 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.968 0.907 . . . . 0.0 110.807 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -100.9 12.2 38.09 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 114.314 -1.312 . . . . 0.0 111.373 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.789 1.636 . . . . 0.0 111.017 -177.919 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 62.8 mt . . . . . 0 C--O 1.232 0.172 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 6.3 mmpt? -75.56 131.6 40.14 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.7 mmt-85 -80.44 28.16 0.33 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.318 1.047 . . . . 0.0 112.315 -177.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -145.76 12.07 1.28 Allowed 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.249 1.02 . . . . 0.0 110.833 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -156.41 -30.27 0.09 Allowed 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.067 0.547 . . . . 0.0 111.634 -177.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 53.63 -128.08 2.36 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 122.656 1.217 . . . . 0.0 109.018 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -166.22 165.66 10.14 Favored Pre-proline 0 C--N 1.314 -0.952 0 CA-C-N 112.416 -2.174 . . . . 0.0 110.292 -174.856 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -67.26 -25.5 42.74 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.858 3.039 . . . . 0.0 109.818 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 33.1 mt-10 -91.67 -47.15 7.54 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.252 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.2 mm100 -70.56 -11.24 60.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.266 0.354 . . . . 0.0 111.628 -174.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.35 -14.3 58.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.49 -51.52 2.86 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.664 0.603 . . . . 0.0 109.922 172.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.7 mt -55.65 -48.44 77.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.919 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.08 -22.5 59.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 118.718 -1.193 . . . . 0.0 110.893 -175.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.49 -29.71 33.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -84.11 -53.7 5.34 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -57.38 -29.19 63.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.854 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 m -81.52 -26.76 34.85 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.725 0.693 . . . . 0.0 112.157 176.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 56.9 tp -90.2 -22.4 21.7 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.397 0.679 . . . . 0.0 112.297 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.7 p -109.06 -4.5 16.57 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 123.007 0.523 . . . . 0.0 111.268 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt 63.64 11.85 6.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 123.455 0.472 . . . . 0.0 111.778 168.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.6 t -97.97 -165.53 1.26 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.628 1.171 . . . . 0.0 110.056 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -84.88 152.23 59.0 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.232 0.613 . . . . 0.0 110.67 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.79 -22.66 31.64 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.403 2.735 . . . . 0.0 111.701 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.66 -16.21 57.59 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 117.862 0.301 . . . . 0.0 110.694 176.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.75 -32.4 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 175.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 52.0 m -60.51 -41.31 94.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 172.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 38.2 ttt-85 -66.61 -23.05 66.13 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 125.26 1.424 . . . . 0.0 112.608 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -99.39 -4.95 30.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 120.148 1.34 . . . . 0.0 111.642 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -107.23 -7.89 16.61 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.1 mt -88.57 -38.27 15.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 171.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 43.3 mt-30 -67.31 -6.75 20.02 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.2 mtp85 -86.57 -14.46 42.81 Favored 'General case' 0 N--CA 1.457 -0.075 0 C-N-CA 122.539 0.335 . . . . 0.0 111.702 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -146.88 37.56 0.97 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.962 0.505 . . . . 0.0 111.709 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 58.08 34.42 24.19 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.485 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.9 m95 58.55 38.33 25.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.427 1.091 . . . . 0.0 112.524 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -88.06 111.77 21.91 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 175.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.1 tt -70.19 -15.15 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 118.944 -1.102 . . . . 0.0 112.265 -169.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.06 -41.39 14.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -178.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -68.59 -42.61 77.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.47 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -34.46 77.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.854 0.862 . . . . 0.0 111.623 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.0 mt -73.24 -33.55 65.37 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.316 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -74.4 -34.12 63.2 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 118.061 0.391 . . . . 0.0 110.213 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.602 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 21.6 t70 -72.48 -41.16 66.32 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.459 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 53.8 t80 -65.4 -38.59 90.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.702 -0.624 . . . . 0.0 111.325 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -74.42 -10.84 59.97 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.168 -0.332 . . . . 0.0 110.421 174.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -88.0 -14.96 37.72 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 117.652 0.206 . . . . 0.0 110.966 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -105.36 -22.29 13.06 Favored 'General case' 0 CA--C 1.523 -0.062 0 C-N-CA 123.688 0.795 . . . . 0.0 111.312 -178.573 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.452 ' C ' ' H ' ' A' ' 56' ' ' GLY . 29.1 mm-40 -104.98 -33.84 8.2 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.525 0.73 . . . . 0.0 110.868 -175.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.6 mt 58.41 0.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 125.805 1.642 . . . . 0.0 113.16 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.452 ' H ' ' C ' ' A' ' 54' ' ' GLU . . . -63.02 3.02 1.13 Allowed Glycine 0 CA--C 1.53 0.983 0 C-N-CA 125.797 1.665 . . . . 0.0 114.007 -177.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 t -105.37 23.54 13.57 Favored 'General case' 0 N--CA 1.461 0.089 0 CA-C-N 118.141 0.971 . . . . 0.0 111.078 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -67.2 -23.48 65.75 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 74.9 p -74.44 30.65 0.08 Allowed 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -174.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.6 4.95 14.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.105 0.955 . . . . 0.0 111.125 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -91.51 13.05 18.82 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.509 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.253 1.239 0 C-N-CA 125.249 1.42 . . . . 0.0 110.374 -178.677 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 49.4 mt . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -76.26 3.84 10.0 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 125.335 1.454 . . . . 0.0 112.875 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? 26.73 33.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 130.621 3.568 . . . . 0.0 114.245 -173.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.2 mttt 44.33 37.3 1.92 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.288 1.035 . . . . 0.0 111.893 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -152.02 -27.21 0.18 Allowed 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 111.979 0.362 . . . . 0.0 111.979 -171.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -163.25 81.5 0.47 Allowed 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 122.396 1.093 . . . . 0.0 109.131 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.512 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -59.43 -178.95 0.14 Allowed Pre-proline 0 N--CA 1.447 -0.584 0 CA-C-N 113.154 -1.839 . . . . 0.0 110.382 173.671 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.512 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.0 Cg_exo -67.01 -28.57 41.52 Favored 'Trans proline' 0 N--CA 1.454 -0.823 1 C-N-CA 125.331 4.021 . . . . 0.0 112.06 -174.215 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 68.0 mt-10 -95.37 -34.83 11.99 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.647 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -72.58 -13.31 61.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 123.498 0.499 . . . . 0.0 111.247 -176.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.05 -14.91 55.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -48.98 3.44 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 169.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.1 mt -60.46 -50.94 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.056 -175.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.11 -20.93 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.672 -1.211 . . . . 0.0 111.115 -174.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -84.19 -28.27 27.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 122.026 0.917 . . . . 0.0 108.65 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -85.62 -58.34 2.7 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.174 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -57.06 -26.14 59.86 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.093 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.4 p -79.1 -38.97 34.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 118.934 0.788 . . . . 0.0 111.627 172.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.7 tp -77.28 -12.71 59.98 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.04 0.536 . . . . 0.0 112.094 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.8 p -123.22 -0.59 8.82 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.257 0.623 . . . . 0.0 111.747 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp 62.98 10.91 4.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.4 p -88.17 -171.82 3.54 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.181 0.593 . . . . 0.0 111.084 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -87.32 146.0 38.96 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -55.9 -23.08 40.88 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.365 2.71 . . . . 0.0 113.691 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -84.72 -11.36 55.99 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.969 0.349 . . . . 0.0 111.255 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -87.87 -38.38 11.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.8 t -57.52 -45.38 85.07 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.9 ttt85 -49.31 -58.48 5.01 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.98 1.312 . . . . 0.0 110.353 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -66.25 -14.38 61.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -174.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.41 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 24.4 m-85 -100.56 -17.77 16.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.229 0.922 . . . . 0.0 110.028 175.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 mt -78.58 -35.8 45.32 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 78.8 mt-30 -65.56 -15.43 62.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.731 0.412 . . . . 0.0 111.645 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -87.15 -10.41 52.78 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 123.674 0.789 . . . . 0.0 111.218 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -140.98 33.62 1.75 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 122.734 0.414 . . . . 0.0 111.398 -172.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 p80 49.19 35.09 6.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 20.6 m95 57.32 38.68 28.64 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.245 1.418 . . . . 0.0 112.724 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.57 119.3 31.37 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.044 -1.835 . . . . 0.0 106.044 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -74.44 -18.28 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 119.024 -1.07 . . . . 0.0 111.734 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -84.87 -42.2 15.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -176.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -68.88 -38.86 79.94 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.803 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.03 -26.67 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.428 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -76.35 -33.44 58.96 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 118.025 0.375 . . . . 0.0 110.341 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -72.72 -34.12 66.89 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.147 0.43 . . . . 0.0 109.953 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.601 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 28.4 t70 -70.82 -40.23 72.58 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.07 -0.394 . . . . 0.0 110.241 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.41 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.1 t80 -66.24 -39.43 89.54 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.689 -0.632 . . . . 0.0 111.245 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -75.81 -6.52 51.1 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 122.219 -0.3 . . . . 0.0 110.674 174.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -90.4 -15.93 30.05 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.609 0.242 . . . . 0.0 110.878 175.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -99.3 -28.0 13.51 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.373 0.669 . . . . 0.0 110.871 -178.221 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -137.97 100.41 4.15 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 122.227 1.013 . . . . 0.0 108.628 173.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.7 mm -63.1 -20.31 25.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 113.987 -1.46 . . . . 0.0 111.281 -178.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.11 -4.04 73.45 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 123.349 0.5 . . . . 0.0 113.053 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -140.58 27.24 2.07 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 117.793 0.796 . . . . 0.0 110.503 177.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -145.84 -37.72 0.25 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.043 . . . . 0.0 109.534 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.4 p -89.41 25.35 1.97 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.81 0.844 . . . . 0.0 110.17 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -87.19 -1.24 57.75 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.073 -177.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.06 22.38 13.01 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.527 1.131 . . . . 0.0 112.757 -178.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.862 -1.066 . . . . 0.0 110.602 178.874 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 121.198 0.523 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HE3' ' CA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -75.04 150.04 39.03 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.016 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -133.28 73.65 1.53 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.428 1.091 . . . . 0.0 109.536 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -76.47 44.96 0.37 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.75 -177.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -121.32 -10.87 8.86 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.95 0.9 . . . . 0.0 111.736 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 55.97 62.7 2.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 122.497 1.141 . . . . 0.0 110.87 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.536 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -52.67 -178.92 0.04 OUTLIER Pre-proline 0 N--CA 1.448 -0.536 0 C-N-CA 126.586 1.954 . . . . 0.0 110.951 169.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.5 Cg_exo -67.62 -29.87 35.8 Favored 'Trans proline' 0 N--CA 1.453 -0.853 1 C-N-CA 125.519 4.146 . . . . 0.0 111.778 -173.767 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 31.5 mt-10 -91.96 -32.93 15.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.356 176.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -76.71 -11.8 59.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.018 0.527 . . . . 0.0 111.16 -174.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.47 -13.18 52.75 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.96 -45.39 3.63 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 170.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.2 mt -61.17 -50.33 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.487 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.0 mt-10 -72.63 -20.74 61.22 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.967 -174.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -83.05 -32.99 26.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -80.09 -59.06 2.86 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.247 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.487 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -56.92 -27.35 60.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.212 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.1 m -82.29 -27.09 32.55 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.076 0.853 . . . . 0.0 112.076 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.7 tp -88.47 -21.03 24.41 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.198 0.599 . . . . 0.0 111.923 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -110.34 -3.2 16.3 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 123.168 0.587 . . . . 0.0 110.89 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt 63.58 12.94 6.87 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 123.647 0.592 . . . . 0.0 111.72 168.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.8 p -88.89 -165.59 1.38 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.911 0.884 . . . . 0.0 110.427 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -97.05 146.62 31.62 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 85.3 Cg_exo -53.29 -18.61 10.94 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.444 2.763 . . . . 0.0 114.257 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -82.77 -13.77 55.68 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.8 0.727 . . . . 0.0 111.846 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -92.05 -36.36 7.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -54.18 -56.58 16.83 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.9 ptp180 -57.45 -39.28 75.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.803 -174.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -73.74 -14.33 61.11 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.034 0.834 . . . . 0.0 112.787 -178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.405 ' CD2' ' NH2' ' A' ' 38' ' ' ARG . 11.0 m-85 -98.44 -26.11 14.57 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 118.762 0.71 . . . . 0.0 109.857 172.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.28 -33.93 61.29 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 70.5 mt-30 -67.35 -12.13 59.42 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.166 0.586 . . . . 0.0 111.511 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.405 ' NH2' ' CD2' ' A' ' 35' ' ' TYR . 33.2 mtm-85 -97.79 -10.39 24.89 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 122.873 0.469 . . . . 0.0 111.463 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -131.03 27.88 4.83 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.368 0.667 . . . . 0.0 110.872 -174.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 53.59 31.7 13.0 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.702 0.801 . . . . 0.0 112.125 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.472 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 16.9 m95 58.77 31.53 21.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.347 1.059 . . . . 0.0 112.378 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.53 110.69 18.87 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -70.42 -15.7 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 119.378 -0.929 . . . . 0.0 111.867 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -85.07 -42.29 14.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.74 -39.91 80.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.646 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.8 -26.03 60.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.757 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.9 -34.84 64.55 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -72.98 -27.21 61.67 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -82.63 -12.18 57.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.746 0.419 . . . . 0.0 111.761 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -98.46 -36.15 10.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.76 1.224 . . . . 0.0 110.926 172.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -71.57 -10.09 59.23 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 172.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -76.51 -15.97 59.76 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 120.922 0.391 . . . . 0.0 110.434 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -102.88 -33.85 9.19 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.764 0.826 . . . . 0.0 110.156 -178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -76.49 -36.12 58.01 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.996 0.918 . . . . 0.0 111.327 -177.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 49.3 mm -86.31 -14.19 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 122.756 0.422 . . . . 0.0 110.009 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.87 -6.44 78.38 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.707 0.67 . . . . 0.0 112.537 -177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.9 t -139.5 27.28 2.29 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.415 0.686 . . . . 0.0 110.286 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.423 ' C ' ' H ' ' A' ' 60' ' ' ASP . 13.5 t80 -75.95 -25.52 56.0 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.336 -174.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.2 p -79.51 24.01 0.38 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.226 0.61 . . . . 0.0 111.241 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.423 ' H ' ' C ' ' A' ' 58' ' ' PHE . 28.4 t70 -111.7 3.8 18.08 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.846 177.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -93.96 13.75 21.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.334 -1.303 . . . . 0.0 111.375 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.252 1.22 0 CA-C-O 117.147 -1.406 . . . . 0.0 109.766 -178.613 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -63.68 128.79 37.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.149 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -97.26 54.84 1.24 Allowed 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.294 1.038 . . . . 0.0 110.391 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -124.39 20.04 8.84 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.149 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -153.94 -30.75 0.12 Allowed 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.672 0.789 . . . . 0.0 110.941 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -155.45 102.87 2.28 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.885 0.85 . . . . 0.0 109.273 174.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -56.03 164.23 1.88 Allowed Pre-proline 0 C--N 1.328 -0.337 0 C-N-CA 125.244 1.418 . . . . 0.0 111.797 176.082 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -64.4 -25.58 63.56 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.215 3.277 . . . . 0.0 110.063 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -90.52 -45.34 9.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.388 -1.733 . . . . 0.0 109.914 177.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.75 -15.63 62.7 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.007 0.523 . . . . 0.0 110.894 -173.138 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.62 -13.53 60.06 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.95 -56.74 2.33 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.077 170.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -51.91 -51.21 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 C-N-CA 123.395 0.678 . . . . 0.0 112.411 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.2 mt-10 -75.55 -20.32 58.74 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 118.153 -1.419 . . . . 0.0 111.127 -173.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.6 t -80.89 -32.35 34.84 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -80.96 -59.22 2.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.6 1.16 . . . . 0.0 109.307 -174.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.48 -28.61 60.21 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.505 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.2 m -81.93 -26.09 34.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.836 0.744 . . . . 0.0 111.776 175.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.75 -23.3 25.52 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.13 0.572 . . . . 0.0 111.87 178.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.9 p -107.6 -3.98 18.76 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.066 0.546 . . . . 0.0 110.791 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt 63.67 12.27 6.44 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.658 0.383 . . . . 0.0 111.473 169.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -94.44 -167.89 1.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.401 1.08 . . . . 0.0 110.792 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -88.17 142.09 31.53 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.034 0.934 . . . . 0.0 109.423 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -64.98 -17.05 58.34 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.276 2.651 . . . . 0.0 113.187 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 11.2 mmpt? -83.22 -9.92 58.87 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.394 0.543 . . . . 0.0 110.329 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -91.86 -35.2 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -57.49 -46.54 83.6 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 76.4 ttt-85 -47.52 -58.45 4.2 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 125.316 1.446 . . . . 0.0 110.052 175.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -68.78 -11.74 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -175.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 19.5 m-85 -102.77 -17.01 15.78 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.398 0.999 . . . . 0.0 109.714 174.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.9 mt -80.07 -35.69 36.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 25.6 mt-30 -65.96 -17.09 64.44 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.761 0.425 . . . . 0.0 111.389 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.3 mtp85 -83.45 -9.52 58.95 Favored 'General case' 0 C--O 1.23 0.042 0 C-N-CA 123.502 0.721 . . . . 0.0 111.062 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -142.01 27.7 1.78 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 54.41 31.34 14.4 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.36 0.664 . . . . 0.0 112.402 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 14.9 m95 60.16 34.5 21.13 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.795 1.238 . . . . 0.0 112.621 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.98 116.91 25.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 172.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -73.29 -17.6 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 118.913 -1.115 . . . . 0.0 111.677 -169.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.59 -42.32 15.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.84 -39.57 79.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.595 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.4 -27.06 62.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.607 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.8 mt -76.08 -33.88 59.53 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.259 0.481 . . . . 0.0 110.508 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -71.66 -35.34 70.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.602 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 28.2 t70 -70.97 -41.38 71.12 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 59.7 t80 -65.24 -39.1 92.26 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 121.635 -0.666 . . . . 0.0 111.182 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -77.14 -4.95 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.389 -0.195 . . . . 0.0 110.782 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.21 -17.54 25.87 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.708 0.231 . . . . 0.0 111.001 174.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -97.4 -27.06 14.64 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.307 0.643 . . . . 0.0 110.955 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -139.3 101.36 4.23 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 172.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mm -61.45 -18.41 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 113.974 -1.466 . . . . 0.0 111.253 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.42 7.98 87.64 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-O 119.657 -0.524 . . . . 0.0 112.991 177.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.2 t -133.82 20.82 3.85 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 117.901 0.851 . . . . 0.0 111.852 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -76.48 -29.97 57.09 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.28 0.562 . . . . 0.0 111.393 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 9.7 t -91.29 30.74 1.22 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.198 -174.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.2 t70 47.73 37.38 6.89 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 122.889 1.328 . . . . 0.0 112.09 -175.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 45.97 28.21 0.59 Allowed 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.675 2.39 . . . . 0.0 114.896 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.953 -1.022 . . . . 0.0 111.167 179.898 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 59.3 mt . . . . . 0 C--O 1.232 0.174 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.403 ' HE3' ' CA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -80.37 142.53 34.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 169.687 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -97.2 20.07 12.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.914 0.886 . . . . 0.0 112.426 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.5 mttt 47.66 23.72 0.45 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.244 1.818 . . . . 0.0 114.7 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -155.6 -59.55 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.057 0.39 . . . . 0.0 111.524 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -166.35 74.09 0.17 Allowed 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 122.393 1.092 . . . . 0.0 109.478 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.539 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -60.25 -177.71 0.13 Allowed Pre-proline 0 N--CA 1.445 -0.682 0 CA-C-N 113.247 -1.797 . . . . 0.0 110.106 172.438 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.5 Cg_exo -67.88 -30.46 33.19 Favored 'Trans proline' 0 N--CA 1.455 -0.785 1 C-N-CA 125.51 4.14 . . . . 0.0 111.166 -175.159 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -88.66 -38.54 14.71 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.477 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 -8.22 57.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -171.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.52 -12.87 53.38 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.88 -49.82 2.85 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.304 170.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.07 -52.47 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 CA-C-N 118.648 0.658 . . . . 0.0 112.282 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.563 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.55 -20.62 59.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 118.387 -1.325 . . . . 0.0 110.803 -172.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 t -80.89 -33.46 34.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -78.25 -63.42 1.4 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.485 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -52.67 -27.65 18.25 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.304 1.041 . . . . 0.0 112.917 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m -84.2 -28.05 27.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.277 0.944 . . . . 0.0 112.039 174.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.82 -18.97 35.82 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.028 0.531 . . . . 0.0 111.473 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.2 p -116.83 -1.87 11.95 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.36 12.33 6.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.542 0.526 . . . . 0.0 112.357 169.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.0 p -86.03 -175.37 5.53 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.956 0.503 . . . . 0.0 110.886 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.446 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.3 t70 -83.55 145.82 48.72 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 53.4 Cg_exo -57.81 -9.29 5.52 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.796 2.997 . . . . 0.0 114.749 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -99.25 -12.71 20.14 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.597 0.635 . . . . 0.0 111.473 177.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -89.47 -38.13 10.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.7 p -54.36 -49.5 69.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.083 0.944 . . . . 0.0 108.601 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 20.3 ttt85 -53.74 -52.36 60.39 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.982 2.513 . . . . 0.0 111.618 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -67.76 -18.01 64.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.694 0.679 . . . . 0.0 112.456 -177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.439 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 22.4 m-85 -95.05 -20.41 19.35 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.041 0.837 . . . . 0.0 110.25 174.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.5 mp -75.36 -39.15 59.59 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.1 mt-30 -64.45 -18.72 65.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.169 0.588 . . . . 0.0 111.717 178.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.5 mtp85 -81.12 -9.44 59.81 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.373 0.669 . . . . 0.0 111.174 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -140.52 27.55 2.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.634 0.374 . . . . 0.0 111.839 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 53.9 33.39 17.12 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.549 0.74 . . . . 0.0 112.116 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.7 m95 59.87 31.6 20.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.519 1.128 . . . . 0.0 112.67 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -86.6 112.08 21.25 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tt -69.75 -16.97 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.912 -170.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -85.26 -42.75 14.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -177.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.55 -38.88 81.18 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.6 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.66 -26.94 61.82 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.6 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -74.22 -34.31 63.65 Favored 'General case' 0 C--N 1.338 0.078 0 CA-C-N 118.222 0.465 . . . . 0.0 109.935 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -71.48 -35.79 70.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.154 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.586 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 30.4 t70 -70.93 -42.09 70.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.3 t80 -66.38 -38.65 88.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.574 -0.704 . . . . 0.0 111.424 177.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -76.78 -5.68 49.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.555 0.161 . . . . 0.0 110.818 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -90.51 -16.72 28.34 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 117.925 0.33 . . . . 0.0 111.215 175.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -98.0 -21.78 16.63 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 123.793 0.837 . . . . 0.0 111.322 -177.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -146.57 81.6 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 124.377 1.071 . . . . 0.0 108.937 176.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.0 mt -70.04 -23.24 25.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.806 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.22 -1.68 79.7 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.463 0.554 . . . . 0.0 112.963 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -139.57 23.63 2.48 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.156 0.979 . . . . 0.0 110.719 178.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -144.92 -39.38 0.26 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.992 -1.004 . . . . 0.0 108.871 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p -86.48 24.11 1.48 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.52 0.728 . . . . 0.0 110.374 172.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -115.91 6.78 14.3 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 124.474 1.11 . . . . 0.0 110.639 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -93.61 12.96 23.54 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.648 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.9 m . . . . . 0 C--O 1.252 1.189 0 C-N-CA 125.457 1.503 . . . . 0.0 110.96 -178.151 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mt . . . . . 0 N--CA 1.457 -0.116 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -68.79 104.2 1.97 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.113 0.965 . . . . 0.0 110.029 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' H ' ' HD3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -75.44 21.48 0.14 Allowed 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -178.018 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -146.62 14.04 1.21 Allowed 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.426 1.09 . . . . 0.0 111.271 -174.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -156.42 -33.25 0.09 Allowed 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 122.965 0.506 . . . . 0.0 111.251 -176.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -157.69 97.29 1.57 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.849 0.833 . . . . 0.0 110.375 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER -52.1 163.94 0.64 Allowed Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 125.233 1.413 . . . . 0.0 112.057 176.115 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -63.52 -25.45 70.06 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.958 3.105 . . . . 0.0 110.009 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -90.73 -45.92 8.56 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 113.625 -1.625 . . . . 0.0 109.885 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.73 -16.19 62.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.171 0.588 . . . . 0.0 110.88 -172.473 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.42 -14.0 60.09 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.81 -54.55 2.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 123.644 0.59 . . . . 0.0 110.176 171.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 mt -52.78 -53.3 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-O 118.737 -0.649 . . . . 0.0 112.267 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.556 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.3 mt-10 -73.18 -21.26 60.72 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 118.088 -1.445 . . . . 0.0 111.072 -173.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.0 t -81.46 -29.6 33.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -85.34 -56.96 3.27 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.153 0.981 . . . . 0.0 109.542 -174.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.556 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -57.06 -27.43 61.69 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.293 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -83.6 -30.33 27.05 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 119.076 0.853 . . . . 0.0 111.533 174.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -81.4 -16.09 53.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.855 0.462 . . . . 0.0 111.325 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -120.11 -1.28 10.37 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.558 0.743 . . . . 0.0 111.705 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp 63.05 10.07 4.23 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.455 0.472 . . . . 0.0 112.242 169.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.5 p -89.33 -172.44 3.62 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.183 0.593 . . . . 0.0 110.925 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -86.94 145.19 37.96 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -55.22 -23.16 35.63 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.387 2.725 . . . . 0.0 113.864 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -83.97 -12.5 55.22 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.026 0.375 . . . . 0.0 111.127 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.7 t -86.48 -38.65 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.5 t -57.71 -47.1 83.32 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.479 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 74.1 ttt-85 -53.52 -23.88 11.76 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 125.072 1.349 . . . . 0.0 112.263 177.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -99.94 -11.04 21.0 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 120.419 1.463 . . . . 0.0 112.315 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.432 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 40.3 m-85 -102.0 -7.36 22.43 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.082 0.401 . . . . 0.0 109.974 171.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.435 HD23 ' CE3' ' A' ' 41' ' ' TRP . 4.7 mp -86.9 -41.98 13.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.026 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 30.9 mt-30 -64.74 -10.43 27.45 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -76.81 -21.85 54.49 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.719 0.808 . . . . 0.0 111.372 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -144.45 35.73 1.19 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.137 0.575 . . . . 0.0 112.399 -171.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 57.55 36.16 26.56 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CE3' HD23 ' A' ' 36' ' ' LEU . 17.0 m95 60.13 46.0 11.09 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.009 0.923 . . . . 0.0 112.602 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -98.68 111.05 23.55 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 175.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 tt -67.06 -17.83 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 120.237 -0.585 . . . . 0.0 112.15 -171.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -86.68 -44.02 12.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.347 -0.845 . . . . 0.0 108.896 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.4 m-30 -66.45 -38.54 87.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.537 177.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.37 -30.74 68.8 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.265 0.626 . . . . 0.0 112.004 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -72.73 -31.54 65.04 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.777 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -74.6 -36.77 62.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.597 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 35.3 t70 -69.16 -44.37 72.4 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 117.803 0.274 . . . . 0.0 110.609 -179.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.432 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 30.3 t80 -68.85 -36.63 78.37 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.694 -0.629 . . . . 0.0 111.506 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -74.88 -7.92 54.94 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.061 -0.399 . . . . 0.0 110.282 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -92.39 -11.42 34.94 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.084 0.154 . . . . 0.0 111.15 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.597 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -113.23 -41.31 3.72 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.103 0.561 . . . . 0.0 112.06 -176.152 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -101.14 -38.39 8.15 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.186 0.594 . . . . 0.0 111.59 -173.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.6 -14.28 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 122.805 0.442 . . . . 0.0 110.102 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.457 ' HA2' ' CZ ' ' A' ' 58' ' ' PHE . . . -72.04 9.76 5.03 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.217 0.913 . . . . 0.0 113.028 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.6 t -93.39 22.65 5.08 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.82 0.848 . . . . 0.0 112.392 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.457 ' CZ ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -56.86 -37.41 71.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.145 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.2 p -81.21 34.71 0.37 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.718 0.807 . . . . 0.0 112.878 -177.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -117.49 4.15 12.45 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.877 0.846 . . . . 0.0 110.884 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -95.21 12.83 27.49 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.274 -1.33 . . . . 0.0 111.454 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 C--O 1.249 1.057 0 CA-C-O 116.966 -1.492 . . . . 0.0 111.295 -178.067 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.0 mp . . . . . 0 CA--C 1.531 0.212 0 CA-C-O 121.276 0.56 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.616 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 8.4 mmpt? -70.55 137.66 50.29 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -105.0 25.74 10.13 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -169.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.3 mttt 50.93 50.15 19.67 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.005 0.922 . . . . 0.0 111.135 -176.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -145.01 -30.79 0.43 Allowed 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.955 0.902 . . . . 0.0 111.132 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.93 101.18 1.93 Allowed 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -51.35 164.15 0.51 Allowed Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 125.229 1.412 . . . . 0.0 112.055 176.744 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -63.76 -26.53 68.07 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 124.003 3.135 . . . . 0.0 109.917 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.424 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 52.4 mt-10 -89.07 -47.51 8.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.169 -1.832 . . . . 0.0 109.892 177.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.593 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.25 -16.27 63.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.753 0.658 . . . . 0.0 111.157 -172.411 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.9 -12.34 59.94 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.95 -51.64 2.77 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.617 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 mt -54.84 -53.15 35.84 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 118.713 -0.661 . . . . 0.0 111.628 -178.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.5 mt-10 -73.93 -20.78 60.28 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.203 -172.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -82.3 -28.62 31.6 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -84.15 -63.81 1.28 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.925 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -49.63 -28.23 5.58 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.341 1.057 . . . . 0.0 112.733 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.3 p -79.51 -39.55 31.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.27 0.941 . . . . 0.0 111.803 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.0 tp -78.19 -18.74 55.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.471 0.709 . . . . 0.0 111.983 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.0 p -111.13 -3.04 15.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.273 0.629 . . . . 0.0 110.801 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 63.82 11.59 6.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.543 0.527 . . . . 0.0 111.935 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -94.49 -174.44 3.33 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.941 0.497 . . . . 0.0 111.606 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -80.94 151.41 70.48 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.098 0.559 . . . . 0.0 111.055 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.88 -2.18 9.82 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.983 3.122 . . . . 0.0 112.217 -177.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -102.37 -7.8 21.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.2 0.6 . . . . 0.0 111.07 175.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.3 t -102.54 -35.28 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.097 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -51.18 -47.81 62.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 122.656 1.217 . . . . 0.0 108.816 172.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -54.82 -52.32 63.07 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 128.757 2.823 . . . . 0.0 112.058 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.05 -14.35 61.84 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.59 0.632 . . . . 0.0 112.474 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.4 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 32.1 m-85 -98.33 -5.3 33.15 Favored 'General case' 0 C--N 1.337 0.037 0 C-N-CA 123.255 0.622 . . . . 0.0 110.233 172.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.0 mp -93.31 -48.15 6.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 173.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -55.86 -25.1 40.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.956 0.502 . . . . 0.0 110.89 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.286 20.3 ttm180 -65.1 -20.64 66.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.988 2.515 . . . . 0.0 113.64 -178.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -144.56 29.95 1.24 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.975 0.91 . . . . 0.0 110.217 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 61.82 36.6 15.99 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.061 0.545 . . . . 0.0 112.059 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.424 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.8 m95 61.05 42.71 12.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.854 1.261 . . . . 0.0 111.884 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -95.35 112.48 24.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.93 -16.71 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.886 -171.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.77 -43.28 12.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -67.12 -39.23 86.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.601 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.4 -31.17 70.33 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.808 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.39 -28.2 60.99 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.906 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.85 -38.4 53.83 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.159 176.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.594 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 19.7 t70 -72.36 -41.75 66.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.916 -0.49 . . . . 0.0 110.995 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.4 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 43.8 t80 -68.3 -36.66 79.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 121.581 -0.699 . . . . 0.0 111.375 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -74.97 -9.16 58.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -90.95 -11.91 37.6 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.61 0.187 . . . . 0.0 111.018 174.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -111.74 -39.95 4.44 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.882 0.473 . . . . 0.0 112.119 -176.002 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -104.55 -40.32 6.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.973 0.509 . . . . 0.0 111.838 -172.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.9 mm -86.83 -13.58 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.909 0.385 . . . . 0.0 110.187 176.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.83 -3.38 55.17 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.667 0.651 . . . . 0.0 112.709 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.9 t -137.27 27.73 2.84 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.659 0.784 . . . . 0.0 109.83 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -115.85 -39.48 3.48 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.201 1.001 . . . . 0.0 111.327 -175.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.4 p -123.17 27.22 7.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.477 1.111 . . . . 0.0 109.947 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -67.49 110.68 3.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.657 -178.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 45.55 29.44 0.63 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.207 1.803 . . . . 0.0 114.42 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.091 -0.957 . . . . 0.0 111.241 178.895 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 CA--C 1.532 0.26 0 CA-C-O 121.35 0.595 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -96.3 113.5 25.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.814 -0.554 . . . . 0.0 109.85 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 8' ' ' ARG . 42.8 mmt-85 -81.53 25.58 0.51 Allowed 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.888 1.275 . . . . 0.0 112.626 -176.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -146.7 12.61 1.15 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.679 1.191 . . . . 0.0 110.474 -176.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -156.68 -21.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.937 0.895 . . . . 0.0 112.808 -174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 58.94 28.42 17.58 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.405 1.082 . . . . 0.0 112.327 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.557 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.0 OUTLIER 35.54 172.58 0.0 OUTLIER Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 129.907 3.283 . . . . 0.0 116.341 -177.118 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -74.15 -27.37 11.81 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.307 2.672 . . . . 0.0 110.513 172.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.407 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 47.5 mt-10 -89.14 -46.37 8.87 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.837 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.9 OUTLIER -70.46 -13.94 62.33 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 125.022 1.329 . . . . 0.0 110.223 -172.039 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -81.43 -12.31 58.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.19 -50.5 2.9 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.281 169.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.7 mt -56.06 -51.94 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HA ' HG22 ' A' ' 22' ' ' THR . 20.0 mt-10 -74.99 -19.64 60.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 118.514 -1.274 . . . . 0.0 110.775 -173.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -82.1 -32.31 30.28 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -81.58 -56.26 4.13 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.783 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.547 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -58.27 -28.69 65.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.409 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -82.92 -26.32 31.59 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 118.856 0.753 . . . . 0.0 111.629 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.4 tp -86.49 -18.65 31.08 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.097 0.559 . . . . 0.0 111.686 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -111.28 -4.17 15.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.149 0.58 . . . . 0.0 111.228 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt 63.4 10.35 4.73 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.558 0.536 . . . . 0.0 111.642 169.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 t -95.04 -170.73 2.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.967 0.907 . . . . 0.0 110.569 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.71 144.65 42.77 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.149 0.58 . . . . 0.0 110.454 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -56.06 -24.45 49.17 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.652 2.901 . . . . 0.0 114.098 -177.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -81.51 -18.8 43.81 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 117.901 0.319 . . . . 0.0 110.481 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -81.99 -34.62 12.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.1 t -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 57.0 ttt85 -47.63 -54.88 10.64 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.541 1.136 . . . . 0.0 110.767 177.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -66.59 -18.79 65.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -176.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -94.58 -21.75 18.64 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.462 1.028 . . . . 0.0 109.976 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 mp -74.18 -37.2 64.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 78.0 mt-30 -66.84 -16.67 64.45 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.124 -0.36 . . . . 0.0 111.801 177.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -84.13 -9.55 58.49 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.183 0.593 . . . . 0.0 110.912 177.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -141.45 26.84 1.93 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.796 0.439 . . . . 0.0 111.706 -171.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 53.62 33.01 15.53 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.605 0.762 . . . . 0.0 112.533 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.407 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 16.2 m95 60.44 33.6 20.63 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.533 1.133 . . . . 0.0 112.379 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -88.82 110.77 21.32 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 172.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.5 tt -69.46 -16.58 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 C-N-CA 119.758 -0.777 . . . . 0.0 112.23 -171.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -85.04 -42.79 14.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.7 -39.74 80.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.815 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.9 -27.66 62.01 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.68 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.1 mt -75.63 -33.59 60.51 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -70.08 -37.46 75.45 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.426 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 24.2 t0 -70.94 -32.14 68.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.298 -0.251 . . . . 0.0 110.713 -178.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -80.6 -35.73 33.73 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.479 -0.763 . . . . 0.0 111.758 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.34 -12.75 45.3 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.484 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 29.2 t70 -93.69 -8.6 40.42 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 175.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.484 ' HE3' ' C ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -113.39 -58.15 2.19 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.342 0.657 . . . . 0.0 110.776 -176.444 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 37.95 27.88 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.314 2.246 . . . . 0.0 114.858 -172.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.4 mm -64.81 -15.07 17.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.416 ' HA2' ' CE2' ' A' ' 58' ' ' PHE . . . -74.5 9.6 10.11 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 123.771 0.701 . . . . 0.0 113.037 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.5 t -88.13 20.17 3.32 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.937 0.895 . . . . 0.0 112.735 -175.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.416 ' CE2' ' HA2' ' A' ' 56' ' ' GLY . 0.1 OUTLIER -61.71 -43.04 99.61 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.924 -0.485 . . . . 0.0 111.691 -173.605 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.5 p -90.18 32.51 0.92 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.247 0.619 . . . . 0.0 112.427 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -114.31 4.56 15.46 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.845 0.831 . . . . 0.0 111.358 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -92.17 13.99 17.44 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.42 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 59.8 t . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.006 1.322 . . . . 0.0 109.878 -178.993 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.6 mt . . . . . 0 N--CA 1.454 -0.226 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.23 142.93 57.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.567 0.747 . . . . 0.0 110.563 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.489 ' H ' ' HD2' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -131.59 23.14 4.7 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.748 0.819 . . . . 0.0 112.357 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -145.44 18.54 1.53 Allowed 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.308 1.043 . . . . 0.0 111.384 -172.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -149.15 -29.3 0.26 Allowed 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 122.746 0.418 . . . . 0.0 112.035 -174.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 51.21 -129.45 2.28 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-O 123.102 1.43 . . . . 0.0 109.746 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -169.36 166.95 5.72 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 112.115 -2.311 . . . . 0.0 109.903 -174.666 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -66.67 -25.66 46.66 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 124.21 3.274 . . . . 0.0 110.039 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 41.4 mt-10 -90.93 -47.35 7.64 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 113.41 -1.723 . . . . 0.0 109.873 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.618 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.12 -14.06 62.48 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.42 0.688 . . . . 0.0 110.828 -173.277 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.25 -14.61 59.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.77 -56.68 2.33 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.052 170.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.1 mt -52.24 -50.08 38.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.57 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.9 mt-10 -76.16 -20.31 57.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 118.272 -1.371 . . . . 0.0 110.695 -174.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -82.41 -26.97 32.3 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -87.1 -52.7 5.28 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -174.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.57 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.9 t -58.87 -30.15 67.52 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.195 178.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -84.23 -28.54 27.19 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.834 0.743 . . . . 0.0 111.992 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.4 tt -84.33 -22.57 30.57 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.094 -0.379 . . . . 0.0 111.209 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.3 p -112.59 -3.23 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.298 0.639 . . . . 0.0 111.77 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp 63.89 9.24 4.37 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.481 0.488 . . . . 0.0 112.032 169.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 t -90.19 -168.86 2.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.991 0.916 . . . . 0.0 109.934 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -86.6 144.38 37.44 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 122.893 0.477 . . . . 0.0 110.365 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -56.97 -26.55 68.67 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.445 2.763 . . . . 0.0 113.498 -177.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -79.51 -18.89 50.95 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.15 0.432 . . . . 0.0 110.797 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.0 t -82.81 -33.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.0 m -60.2 -46.77 88.61 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.5 ttt-85 -60.47 -37.54 81.33 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 125.479 1.512 . . . . 0.0 112.088 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -86.19 -8.2 57.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 119.519 1.054 . . . . 0.0 113.114 -175.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.407 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 14.8 m-85 -99.73 -22.64 15.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 24.7 mt -75.47 -34.85 60.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.458 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 50.6 mt-30 -68.33 -11.89 60.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -94.98 -5.56 44.37 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.796 0.438 . . . . 0.0 110.955 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -136.84 27.26 2.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.528 0.731 . . . . 0.0 111.408 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 54.39 31.32 14.32 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.661 0.784 . . . . 0.0 112.35 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.1 m95 58.97 31.85 21.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.532 1.133 . . . . 0.0 112.649 -178.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.93 117.41 23.91 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 173.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tt -73.62 -17.1 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 118.802 -1.159 . . . . 0.0 112.013 -169.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -85.68 -41.89 14.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.83 -40.15 79.62 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.683 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.14 -27.78 62.83 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.541 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.6 mt -75.53 -31.63 60.17 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.361 177.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -72.94 -31.7 64.77 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.069 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.59 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 38.7 t70 -71.94 -34.79 69.31 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 56.5 t80 -71.65 -44.84 63.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.796 -0.565 . . . . 0.0 111.268 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -64.89 -16.28 63.04 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 117.814 0.279 . . . . 0.0 110.39 176.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.6 -11.56 55.75 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.636 0.374 . . . . 0.0 110.777 177.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -110.56 -12.08 14.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.416 0.687 . . . . 0.0 112.367 -174.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -78.26 -5.75 52.91 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.43 0.559 . . . . 0.0 111.04 175.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.5 mm -69.08 -14.65 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 C-N-CA 123.373 0.669 . . . . 0.0 110.601 -179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.83 9.4 86.53 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.4 t -79.63 27.28 0.28 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.825 0.821 . . . . 0.0 111.195 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -87.38 -29.95 21.12 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.956 0.902 . . . . 0.0 111.145 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.5 p -97.28 23.58 7.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.837 0.855 . . . . 0.0 109.888 175.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -77.28 1.62 18.13 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.888 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -120.7 19.48 11.85 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.918 1.287 . . . . 0.0 111.197 177.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.607 1.963 . . . . 0.0 111.918 -178.83 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.7 tt . . . . . 0 N--CA 1.452 -0.372 0 CA-C-O 121.543 0.687 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -63.25 119.1 8.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.384 0.673 . . . . 0.0 109.895 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.1 mmm-85 -99.65 24.81 7.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.731 1.212 . . . . 0.0 111.88 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 49.13 28.83 2.28 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.921 1.288 . . . . 0.0 112.601 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -153.4 -32.2 0.12 Allowed 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 122.762 0.425 . . . . 0.0 111.304 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.73 103.66 2.1 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 122.305 1.05 . . . . 0.0 109.957 176.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.489 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.1 t -52.26 165.45 0.51 Allowed Pre-proline 0 N--CA 1.452 -0.337 0 C-N-CA 126.127 1.771 . . . . 0.0 112.28 174.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -63.5 -25.98 70.13 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.805 3.004 . . . . 0.0 110.043 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 32.9 mt-10 -91.36 -46.37 8.06 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.796 -1.547 . . . . 0.0 109.773 177.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 8.8 mm100 -70.37 -12.5 61.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 123.343 0.402 . . . . 0.0 111.796 -174.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -79.36 -15.18 58.32 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.25 -51.56 2.86 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.794 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.6 mt -56.16 -48.93 78.51 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.948 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' HG22 ' A' ' 22' ' ' THR . 16.7 mt-10 -75.67 -21.25 57.81 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.374 -175.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 t -81.3 -34.68 31.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -76.3 -62.33 1.65 Allowed 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.111 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.535 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -54.44 -29.66 50.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.867 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -81.2 -25.64 36.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 119.056 0.844 . . . . 0.0 112.073 175.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.6 tp -89.97 -22.53 21.89 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.927 0.491 . . . . 0.0 112.077 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.6 p -109.02 -3.75 17.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.238 0.615 . . . . 0.0 111.056 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt 63.51 13.5 7.25 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.707 0.403 . . . . 0.0 111.854 168.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.7 p -87.38 -169.5 2.64 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.627 0.771 . . . . 0.0 110.65 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.458 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.5 t70 -88.15 144.39 34.29 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -59.29 -7.93 5.9 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.995 3.13 . . . . 0.0 114.683 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.552 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 10.7 mmpt? -97.95 -10.76 23.98 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.657 0.662 . . . . 0.0 111.208 176.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -91.53 -38.72 10.86 Favored 'Isoleucine or valine' 0 C--N 1.337 0.06 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -53.4 -44.03 68.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 122.324 1.059 . . . . 0.0 109.157 174.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 62.8 ttt-85 -63.85 -33.14 75.02 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.101 2.56 . . . . 0.0 112.066 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -88.73 -9.87 50.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 119.224 0.92 . . . . 0.0 112.522 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -97.58 -24.64 15.46 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.2 -35.56 63.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.2 mt-30 -67.38 -12.81 61.15 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -94.63 -7.6 40.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.981 0.513 . . . . 0.0 111.348 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -133.41 27.18 4.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.291 0.636 . . . . 0.0 111.144 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 53.21 31.16 11.06 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.668 0.787 . . . . 0.0 112.223 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.7 m95 58.43 33.21 22.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.593 1.157 . . . . 0.0 112.275 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.07 116.01 22.65 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.21 -16.96 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.929 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.04 -41.18 16.03 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -69.74 -40.37 76.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.679 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.48 -27.68 62.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 122.703 0.401 . . . . 0.0 111.364 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.68 -34.31 64.83 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -73.11 -30.52 63.7 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -17.52 59.38 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 122.579 0.352 . . . . 0.0 111.759 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.28 -36.17 11.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.477 1.111 . . . . 0.0 111.621 174.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -75.05 -5.13 42.43 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.239 -0.288 . . . . 0.0 110.372 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.28 -16.86 44.64 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.677 0.391 . . . . 0.0 111.122 175.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -96.97 -33.65 11.5 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.994 0.917 . . . . 0.0 110.199 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -132.61 97.25 4.02 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 122.283 1.039 . . . . 0.0 109.215 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mm -63.15 -19.87 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 113.877 -1.51 . . . . 0.0 110.574 178.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 87.14 -3.75 86.64 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.496 0.569 . . . . 0.0 112.103 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -151.68 28.41 0.62 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.453 0.626 . . . . 0.0 111.317 179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -122.8 -125.55 0.26 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.746 1.218 . . . . 0.0 107.838 -176.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.5 p -97.63 28.27 3.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.615 0.766 . . . . 0.0 111.925 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -96.12 -2.19 47.02 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 124.038 0.935 . . . . 0.0 112.088 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -95.36 15.4 19.57 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 125.687 1.595 . . . . 0.0 111.315 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.89 1.276 . . . . 0.0 109.897 -178.265 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.482 ' O ' HG22 ' A' ' 6' ' ' ILE . 24.2 mm . . . . . 0 CA--C 1.531 0.238 0 CA-C-O 122.339 1.066 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 9' ' ' LYS . 34.9 mmtp -82.82 42.58 0.79 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.073 0.949 . . . . 0.0 111.266 -178.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -74.64 24.45 0.09 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 124.269 1.027 . . . . 0.0 112.009 178.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.46 ' H ' ' C ' ' A' ' 7' ' ' LYS . 86.8 mttt -144.47 14.7 1.61 Allowed 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.376 1.071 . . . . 0.0 111.161 -172.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -148.47 -24.49 0.33 Allowed 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 59.77 69.96 0.67 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.518 1.151 . . . . 0.0 110.393 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -51.61 -175.08 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.471 0 C-N-CA 127.654 2.382 . . . . 0.0 110.726 169.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 90.3 Cg_endo -83.43 -21.11 4.53 Favored 'Trans proline' 0 N--CA 1.451 -1.0 1 C-N-CA 125.534 4.156 . . . . 0.0 109.805 -168.142 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.509 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 20.9 mt-10 -98.81 -28.21 13.59 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.312 175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.403 ' HG2' ' HB3' ' A' ' 12' ' ' SER . 4.1 mm100 -79.07 -14.38 59.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -175.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -81.05 -11.18 59.57 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' PHE . . . -112.67 -49.16 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.072 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.42 -47.93 88.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 CA-C-N 118.843 0.747 . . . . 0.0 111.77 -178.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.3 mt-10 -75.14 -20.3 59.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.827 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -84.41 -28.9 26.59 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 17' ' ' ALA . 27.7 t80 -83.66 -54.12 5.16 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -175.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.3 t -56.71 -30.37 63.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.424 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.8 m -83.4 -26.95 29.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 0.77 . . . . 0.0 111.811 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.4 tp -87.24 -16.41 35.32 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.0 p -119.95 -1.49 10.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 122.806 0.442 . . . . 0.0 111.721 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.96 10.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 169.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.04 -168.58 2.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.159 0.584 . . . . 0.0 110.355 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -87.79 143.88 34.2 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 77.6 Cg_exo -55.61 -24.06 43.27 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.303 2.669 . . . . 0.0 113.71 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -78.68 -19.25 52.93 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 121.867 -0.52 . . . . 0.0 110.738 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -82.66 -32.67 10.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 175.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.2 m -62.5 -47.35 84.35 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.481 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 46.3 ttt85 -57.5 -39.18 75.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 111.948 178.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -81.26 -19.06 43.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 119.527 1.058 . . . . 0.0 113.234 -177.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.63 -24.61 19.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 119.258 0.935 . . . . 0.0 109.861 176.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mp -70.19 -36.8 74.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.7 mt-30 -67.57 -12.61 60.78 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -93.8 -7.06 44.49 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.169 0.588 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -134.47 25.51 3.77 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.252 0.621 . . . . 0.0 111.337 -175.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 54.08 31.62 14.12 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.363 0.665 . . . . 0.0 111.729 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.509 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 14.5 m95 59.24 32.84 22.31 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.816 1.246 . . . . 0.0 112.416 -177.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.3 110.76 19.31 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.4 tt -69.45 -16.61 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.031 -170.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.62 -42.57 14.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.13 -39.38 82.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.488 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.83 61.01 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.598 -177.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.1 mt -73.18 -33.35 65.38 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -72.09 -32.91 67.46 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.589 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.8 t70 -70.02 -37.68 75.68 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.344 -0.223 . . . . 0.0 110.457 178.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -73.26 -41.04 64.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.845 -0.534 . . . . 0.0 111.657 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.12 -9.48 55.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.093 0.406 . . . . 0.0 110.37 175.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.55 -14.34 32.76 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.838 0.455 . . . . 0.0 110.662 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.589 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -106.34 -7.11 17.86 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -171.208 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.97 -7.92 53.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 118.01 0.368 . . . . 0.0 111.226 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 mt -141.66 -47.51 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.866 0.866 . . . . 0.0 109.461 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.43 ' HA2' ' CE2' ' A' ' 58' ' ' PHE . . . -87.8 81.86 1.6 Allowed Glycine 0 C--N 1.335 0.503 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.4 t -87.96 15.15 7.62 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 121.724 0.773 . . . . 0.0 112.176 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.43 ' CE2' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -81.2 -40.6 23.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.754 178.324 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.4 p -87.4 35.54 0.72 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.991 0.917 . . . . 0.0 111.36 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -121.17 11.69 10.92 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.975 0.91 . . . . 0.0 111.549 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -84.68 24.64 1.0 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.082 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 C--O 1.252 1.2 0 CA-C-O 117.43 -1.271 . . . . 0.0 109.438 -178.833 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 N--CA 1.454 -0.233 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -69.75 159.61 33.24 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.505 0.669 . . . . 0.0 110.717 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 mmm-85 -113.91 26.82 10.01 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.411 1.085 . . . . 0.0 108.984 170.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 52.09 48.51 22.57 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 123.619 0.768 . . . . 0.0 110.93 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -105.49 -0.64 25.72 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 124.249 1.02 . . . . 0.0 110.308 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 62.82 70.22 0.56 Allowed 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.493 1.517 . . . . 0.0 110.698 -177.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.54 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -54.77 -178.6 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.595 0 C-N-CA 127.046 2.138 . . . . 0.0 110.877 172.044 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.54 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.9 Cg_exo -66.98 -30.54 39.13 Favored 'Trans proline' 0 N--CA 1.456 -0.716 1 C-N-CA 125.479 4.119 . . . . 0.0 111.898 -173.866 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.468 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 57.7 mt-10 -92.7 -35.27 13.57 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.349 176.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -75.14 -8.44 56.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.13 0.572 . . . . 0.0 111.399 -175.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.95 -14.68 43.96 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.02 -47.7 3.39 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.768 171.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.6 mt -58.16 -51.81 66.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.706 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.477 ' HA ' HG22 ' A' ' 22' ' ' THR . 23.5 mt-10 -70.8 -23.39 62.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 118.779 -1.168 . . . . 0.0 111.164 -175.001 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.2 t -81.04 -34.29 32.92 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -79.12 -61.3 2.06 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.403 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.477 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.5 t -53.75 -28.73 36.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.079 0.951 . . . . 0.0 112.618 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.5 m -83.31 -28.08 29.32 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 119.078 0.854 . . . . 0.0 111.812 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 tp -84.28 -16.7 42.18 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.055 0.542 . . . . 0.0 111.781 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.4 p -118.51 -2.04 11.1 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 122.875 0.47 . . . . 0.0 111.752 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp 63.23 10.4 4.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 169.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -89.17 -174.55 4.47 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.812 0.445 . . . . 0.0 110.745 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -80.92 150.46 69.01 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 122.271 0.228 . . . . 0.0 110.89 178.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.4 -22.55 50.71 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -86.72 -10.08 54.5 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -97.85 -36.34 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.8 p -54.9 -36.97 65.76 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 122.341 1.067 . . . . 0.0 109.411 174.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 31.4 ttt85 -67.73 -54.16 21.61 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 127.909 2.483 . . . . 0.0 110.942 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -67.29 -10.0 46.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 28.5 m-85 -105.24 -9.3 17.77 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.65 0.659 . . . . 0.0 110.442 174.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -86.44 -38.77 17.0 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.411 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 81.3 mt-30 -63.7 -16.26 60.61 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.334 0.654 . . . . 0.0 112.761 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -78.32 -15.86 58.3 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.037 0.535 . . . . 0.0 111.605 -178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -143.67 36.52 1.31 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.746 0.419 . . . . 0.0 111.812 -173.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 57.66 33.34 23.11 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 13.9 m95 60.52 39.74 17.77 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.323 1.049 . . . . 0.0 112.306 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -89.6 111.18 22.05 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 174.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -68.19 -16.59 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.932 -169.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.17 -42.33 13.93 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.71 -41.29 83.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.817 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.83 74.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.748 0.819 . . . . 0.0 111.63 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.07 -33.49 63.69 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.148 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.8 -36.7 65.03 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.058 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.587 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 20.5 t70 -68.64 -43.52 76.14 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.8 t80 -64.06 -41.3 97.4 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.954 -0.466 . . . . 0.0 111.27 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -72.06 -4.07 26.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.171 0.189 . . . . 0.0 111.031 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -96.82 -5.87 37.33 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 122.401 -0.187 . . . . 0.0 111.343 173.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE3' ' O ' ' A' ' 49' ' ' ASP . 0.0 OUTLIER -117.22 -29.88 5.77 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.459 0.703 . . . . 0.0 112.403 -174.837 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' H ' ' HG3' ' A' ' 54' ' ' GLU . 0.6 OUTLIER -81.71 -3.15 52.91 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.789 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 36.7 mm -60.58 -21.99 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 123.901 0.881 . . . . 0.0 110.532 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.01 90.71 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 122.104 -0.373 . . . . 0.0 112.879 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.8 t -90.33 23.76 2.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.901 0.858 . . . . 0.0 110.855 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -84.66 -27.12 27.32 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.012 0.925 . . . . 0.0 111.319 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.9 p -85.8 21.56 1.86 Allowed 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.437 0.695 . . . . 0.0 110.653 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -90.94 1.29 57.15 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.545 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -92.56 13.41 19.93 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 124.889 1.275 . . . . 0.0 111.62 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.251 1.166 0 CA-C-O 117.074 -1.441 . . . . 0.0 110.931 -178.878 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.653 0.739 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -56.88 133.28 54.42 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.566 0.747 . . . . 0.0 109.908 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -121.51 64.07 0.9 Allowed 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.472 1.109 . . . . 0.0 109.837 -172.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 48.17 49.55 17.37 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 114.672 -1.149 . . . . 0.0 111.778 176.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -98.73 -7.06 28.32 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.5 0.72 . . . . 0.0 110.167 -176.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 50.62 73.47 0.28 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.463 1.505 . . . . 0.0 111.424 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER -44.67 164.58 0.17 Allowed Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 125.96 1.704 . . . . 0.0 112.47 171.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -62.09 -25.72 77.59 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.134 3.222 . . . . 0.0 109.69 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.445 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 44.9 mt-10 -90.15 -43.96 10.1 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.877 177.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.576 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -73.24 -15.75 61.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.644 0.59 . . . . 0.0 110.926 -172.037 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -76.47 -13.29 60.11 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.07 -54.56 2.6 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.094 170.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.409 ' O ' HG22 ' A' ' 22' ' ' THR . 11.3 mt -53.44 -52.26 33.96 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.58 0 CA-C-O 118.854 -0.593 . . . . 0.0 112.181 -178.033 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.551 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.7 mt-10 -74.07 -21.0 60.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.936 -173.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -80.18 -33.39 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -80.74 -59.51 2.65 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.207 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.551 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -55.62 -28.84 57.51 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.377 1.071 . . . . 0.0 112.323 179.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 m -82.05 -26.24 33.9 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.2 0.909 . . . . 0.0 111.898 174.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -86.87 -22.69 25.6 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.133 0.573 . . . . 0.0 112.051 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -109.0 -3.52 17.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 123.509 0.724 . . . . 0.0 110.864 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt 64.0 12.34 6.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.421 0.451 . . . . 0.0 112.121 168.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -90.02 -165.23 1.3 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.43 0.692 . . . . 0.0 111.041 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -92.7 145.01 29.54 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.16 0.584 . . . . 0.0 109.628 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.09 -25.59 46.15 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.423 2.749 . . . . 0.0 113.807 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.4 -11.73 59.66 Favored 'General case' 0 C--O 1.228 -0.071 0 CA-C-N 118.147 0.431 . . . . 0.0 111.203 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -90.74 -37.53 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.1 t -58.35 -44.67 88.85 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.6 ttt85 -48.87 -58.28 5.09 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 125.066 1.346 . . . . 0.0 110.603 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -68.18 -13.4 62.21 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 21.3 m-85 -100.97 -18.03 16.5 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.225 0.921 . . . . 0.0 110.118 175.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.2 mt -79.67 -35.28 39.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 80.4 mt-30 -66.05 -17.22 64.55 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.507 0.323 . . . . 0.0 111.461 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 -83.0 -10.18 58.91 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.385 0.674 . . . . 0.0 110.941 177.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -141.28 27.91 1.89 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.7 0.4 . . . . 0.0 111.864 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 54.32 31.25 14.0 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.518 0.727 . . . . 0.0 112.283 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.5 m95 60.09 34.31 21.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.52 1.128 . . . . 0.0 112.827 -178.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -86.91 116.39 24.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -72.74 -17.37 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 118.958 -1.097 . . . . 0.0 111.898 -170.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.79 -42.27 15.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -68.97 -39.76 79.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.63 63.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.432 -177.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 31.0 mt -75.71 -33.78 60.34 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 118.014 0.37 . . . . 0.0 110.191 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -71.79 -35.34 69.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.234 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.598 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 27.2 t70 -70.28 -42.86 71.55 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.707 0.289 . . . . 0.0 110.35 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.417 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 47.2 t80 -64.43 -38.49 91.21 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.548 -0.72 . . . . 0.0 111.408 177.428 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -77.57 -5.6 50.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.256 0.222 . . . . 0.0 110.841 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -91.03 -16.56 27.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 117.777 0.262 . . . . 0.0 111.206 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.598 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -98.44 -22.74 15.88 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.685 0.794 . . . . 0.0 111.268 -177.817 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -144.99 83.26 1.69 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.519 1.152 . . . . 0.0 108.653 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.2 mt -70.02 -17.09 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 113.864 -1.516 . . . . 0.0 110.863 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 0.64 74.95 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 123.796 0.712 . . . . 0.0 111.698 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.5 t -140.26 23.27 2.37 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 123.726 0.81 . . . . 0.0 110.606 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -92.41 -34.35 14.18 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.231 1.012 . . . . 0.0 110.597 -177.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 22.5 p -95.09 24.72 4.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.714 0.806 . . . . 0.0 110.036 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -68.73 110.72 4.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.925 0.869 . . . . 0.0 110.379 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 44.65 26.98 0.21 Allowed 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.851 2.461 . . . . 0.0 114.95 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.8 m . . . . . 0 C--O 1.25 1.118 0 CA-C-O 117.055 -1.45 . . . . 0.0 111.345 177.744 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 111.495 0.183 . . . . 0.0 111.495 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -64.29 -24.92 64.7 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.856 3.037 . . . . 0.0 109.927 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -92.55 -45.75 7.96 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.104 176.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.4 mm-40 -69.41 -13.49 62.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.727 -175.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.94 -14.47 59.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.73 -49.77 3.11 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 171.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt -58.6 -50.72 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.103 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.69 -20.97 61.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.571 -1.252 . . . . 0.0 111.201 -175.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.1 t -82.51 -32.16 28.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -81.33 -58.18 3.16 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.3 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -58.38 -26.88 63.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.031 0.932 . . . . 0.0 112.567 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.9 m -83.03 -28.49 29.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 118.711 0.687 . . . . 0.0 111.562 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.5 tp -83.95 -14.91 49.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.023 0.529 . . . . 0.0 111.757 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 p -121.91 -0.72 9.5 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.299 0.639 . . . . 0.0 111.927 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp 63.45 11.77 5.83 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 169.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.3 p -86.99 -172.57 4.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.979 0.512 . . . . 0.0 110.652 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.0 t70 -86.15 145.58 40.81 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 74.4 Cg_exo -54.6 -23.81 34.02 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.309 2.673 . . . . 0.0 113.845 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -83.85 -12.12 56.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.494 0.318 . . . . 0.0 111.277 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.04 -39.04 13.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.0 t -57.81 -44.68 86.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 174.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 75.9 ttt-85 -55.66 -23.88 30.67 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.912 1.285 . . . . 0.0 112.091 176.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -102.5 -6.51 22.81 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 120.052 1.296 . . . . 0.0 112.679 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -103.06 -16.22 15.84 Favored 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.8 mt -80.21 -39.58 28.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 40.8 mt-30 -68.0 -11.85 59.66 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 176.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -87.49 -12.78 44.96 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.631 0.372 . . . . 0.0 111.127 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -141.23 36.29 1.71 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.832 0.453 . . . . 0.0 111.37 -171.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 47.75 42.33 15.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 112.327 176.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.423 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 26.6 m95 50.86 35.77 13.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.524 1.53 . . . . 0.0 112.925 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -91.65 118.17 30.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tt -73.84 -18.16 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.805 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -84.75 -41.77 15.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -70.67 -36.94 73.58 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.81 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -26.83 61.36 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.523 0.329 . . . . 0.0 111.364 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.4 mt -76.63 -34.75 58.31 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 117.967 0.349 . . . . 0.0 110.392 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.04 -34.37 71.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -70.87 -40.38 72.31 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 122.2 -0.313 . . . . 0.0 110.274 178.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 28.2 t80 -68.95 -37.63 78.94 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.554 -0.716 . . . . 0.0 111.02 177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -73.19 -8.98 58.16 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 122.288 -0.257 . . . . 0.0 110.35 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.53 0.209 0 C-N-CA 122.24 0.216 . . . . 0.0 111.063 175.238 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.578 0 CA-C-O 120.919 0.39 . . . . 0.0 110.195 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.8 Cg_exo -68.01 -28.89 34.73 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.338 4.025 . . . . 0.0 111.924 -174.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 30.6 mt-10 -93.29 -32.98 14.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.457 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.81 -15.8 61.17 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.157 0.583 . . . . 0.0 111.034 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -80.25 -13.67 59.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -107.5 -49.1 3.31 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.653 169.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.9 mt -60.21 -49.55 83.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.169 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.0 mt-10 -72.98 -21.14 60.89 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.123 -175.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -81.87 -33.31 30.63 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -80.48 -59.29 2.75 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.707 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -56.26 -29.1 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.436 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -82.01 -28.26 32.65 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.113 0.87 . . . . 0.0 111.819 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.9 tp -83.65 -17.54 41.15 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.741 0.416 . . . . 0.0 111.92 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.3 p -121.23 -0.33 9.94 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 122.999 0.519 . . . . 0.0 111.675 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.1 11.75 5.47 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 169.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.4 p -86.73 -169.7 2.75 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.222 0.609 . . . . 0.0 111.098 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 12.8 t70 -88.87 145.14 34.12 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 75.9 Cg_exo -54.07 -24.2 31.88 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.529 2.82 . . . . 0.0 114.136 -177.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 -16.97 45.78 Favored 'General case' 0 CA--C 1.522 -0.133 0 O-C-N 121.998 -0.439 . . . . 0.0 110.933 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.7 t -81.73 -35.63 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.0 t -60.52 -48.85 79.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.415 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.8 ttt85 -49.39 -57.75 6.37 Favored 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 124.727 1.211 . . . . 0.0 110.214 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -65.79 -13.95 60.45 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -102.19 -18.61 15.44 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.459 1.027 . . . . 0.0 109.981 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 34.0 mt -76.63 -34.95 58.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.0 mt-30 -67.14 -15.96 64.03 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.848 0.459 . . . . 0.0 111.719 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.2 mtp85 -87.86 -10.49 50.6 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.772 0.829 . . . . 0.0 111.094 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -141.03 34.47 1.74 Allowed 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.874 0.47 . . . . 0.0 111.374 -172.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 46.95 40.25 8.97 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.484 0.714 . . . . 0.0 112.183 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 23.4 m95 52.1 36.77 19.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 125.541 1.536 . . . . 0.0 113.153 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -92.15 120.25 32.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 172.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tt -74.61 -18.44 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 119.058 -1.057 . . . . 0.0 111.603 -170.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -84.4 -42.12 16.0 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -69.9 -37.94 76.16 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.915 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.52 -25.78 60.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 122.612 0.365 . . . . 0.0 111.386 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.9 mt -77.32 -33.41 55.56 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 118.009 0.368 . . . . 0.0 110.292 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -72.22 -34.65 68.5 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 122.033 -0.417 . . . . 0.0 110.06 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -70.14 -38.0 75.39 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 178.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -69.52 -41.81 75.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 121.72 -0.612 . . . . 0.0 111.491 177.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -69.54 -11.24 60.67 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 117.891 0.314 . . . . 0.0 110.328 176.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.53 0.18 0 C-N-CA 122.551 0.34 . . . . 0.0 110.865 175.925 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.523 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 121.02 0.438 . . . . 0.0 110.764 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.4 Cg_exo -66.48 -28.78 45.58 Favored 'Trans proline' 0 N--CA 1.456 -0.693 1 C-N-CA 125.632 4.221 . . . . 0.0 112.015 -173.34 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 59.2 mt-10 -95.2 -31.36 13.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.735 176.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -76.69 -12.22 59.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 123.497 0.498 . . . . 0.0 110.791 -175.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -82.52 -14.65 54.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.74 -49.25 3.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.977 169.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -60.31 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.88 -176.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.493 ' HA ' HG22 ' A' ' 22' ' ' THR . 22.5 mt-10 -72.44 -20.59 61.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.049 -175.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 t -83.35 -30.38 27.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -83.3 -59.19 2.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.377 1.071 . . . . 0.0 109.75 -176.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.11 -28.79 59.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.547 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.8 m -83.31 -29.63 28.17 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 119.244 0.929 . . . . 0.0 112.018 175.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -81.24 -16.56 52.31 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.587 0.355 . . . . 0.0 111.108 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -120.62 -1.95 9.99 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.148 0.579 . . . . 0.0 112.016 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp 62.81 10.36 4.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.0 p -89.98 -164.02 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.72 0.808 . . . . 0.0 111.503 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -91.11 144.92 30.66 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.733 0.813 . . . . 0.0 110.427 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.58 -22.27 27.63 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.137 2.558 . . . . 0.0 113.669 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -77.95 -31.35 50.84 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.7 p -83.75 -25.43 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.139 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.3 t -61.82 -51.27 68.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 47.3 ttt85 -51.4 -58.78 5.3 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 125.386 1.475 . . . . 0.0 110.585 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -63.06 -17.84 62.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -176.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 11.7 m-85 -100.42 -18.11 16.88 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.373 0.988 . . . . 0.0 110.245 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.4 mt -75.25 -34.81 61.43 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 172.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 81.4 mt-30 -67.55 -14.69 63.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.858 0.463 . . . . 0.0 111.55 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -90.18 -9.65 47.39 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 124.036 0.935 . . . . 0.0 111.355 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -140.28 33.74 1.89 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.909 0.484 . . . . 0.0 111.362 -172.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.8 p80 49.01 35.54 7.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.347 1.059 . . . . 0.0 112.489 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.477 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 21.0 m95 56.06 38.26 29.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.681 1.593 . . . . 0.0 112.416 -178.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -88.99 120.12 30.12 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 171.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -75.14 -17.83 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 118.757 -1.177 . . . . 0.0 111.775 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.11 -41.0 16.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -176.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.7 -38.41 73.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.024 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.67 -26.54 61.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.487 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.1 mt -76.63 -35.07 58.25 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.01 0.368 . . . . 0.0 110.162 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.6 -36.3 70.79 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -69.4 -40.67 77.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.426 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 64.3 t80 -68.83 -41.22 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.767 -0.583 . . . . 0.0 111.274 177.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -69.53 -8.32 46.11 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 117.651 0.205 . . . . 0.0 110.641 175.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 CA--C 1.531 0.238 0 C-N-CA 122.179 0.192 . . . . 0.0 110.943 175.452 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.506 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.522 0 CA-C-O 121.342 0.592 . . . . 0.0 111.213 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.4 Cg_exo -67.43 -28.6 38.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.329 4.02 . . . . 0.0 111.602 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.473 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 29.3 mt-10 -92.84 -32.31 14.67 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.381 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -76.63 -13.65 60.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.752 0.421 . . . . 0.0 111.186 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -82.55 -12.34 57.82 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.17 -50.12 3.04 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 28.9 mt -57.82 -48.79 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 CA-C-O 118.736 -0.649 . . . . 0.0 112.295 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.505 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -74.08 -20.94 60.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.111 -175.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -82.83 -31.52 28.03 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -82.63 -56.29 3.94 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.27 -175.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.44 -28.05 64.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.144 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 m -81.34 -27.96 34.7 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.992 0.815 . . . . 0.0 111.983 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.5 tp -86.66 -20.01 28.42 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.071 0.548 . . . . 0.0 111.877 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.9 p -110.05 -4.03 16.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 123.319 0.648 . . . . 0.0 111.302 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.1 mmtt 63.03 11.56 5.25 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.509 0.505 . . . . 0.0 111.649 169.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.0 t -93.15 -164.31 1.16 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.222 1.009 . . . . 0.0 109.926 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -96.84 145.53 29.74 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 122.92 0.488 . . . . 0.0 110.303 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 73.7 Cg_exo -54.06 -17.83 12.09 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.592 2.862 . . . . 0.0 114.509 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -83.66 -10.09 58.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.893 0.77 . . . . 0.0 111.844 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -96.94 -36.48 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.8 t -52.62 -52.17 56.68 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.463 0.649 . . . . 0.0 109.763 177.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.6 ptp180 -59.89 -36.42 76.91 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.676 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -77.19 -11.56 59.83 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 119.373 0.988 . . . . 0.0 112.724 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 17.3 m-85 -102.32 -20.51 14.58 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 118.967 0.803 . . . . 0.0 109.682 172.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -76.23 -37.13 58.09 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 72.3 mt-30 -68.49 -12.99 62.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.237 0.615 . . . . 0.0 111.324 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -90.07 -10.55 44.34 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 123.695 0.798 . . . . 0.0 111.388 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -140.17 30.38 1.99 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.814 0.445 . . . . 0.0 111.593 -171.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 53.56 32.12 13.71 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 123.705 0.802 . . . . 0.0 112.584 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.473 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 18.8 m95 58.9 31.93 21.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.723 1.209 . . . . 0.0 112.776 -178.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -84.6 114.01 21.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 172.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -71.87 -16.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 C-N-CA 118.744 -1.182 . . . . 0.0 111.636 -169.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -84.85 -42.71 14.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -68.26 -40.39 81.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.662 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.89 63.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.567 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.85 -34.7 62.33 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.058 0.39 . . . . 0.0 110.273 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -72.29 -29.45 63.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -78.51 -17.54 56.08 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.122 0.569 . . . . 0.0 111.194 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 40.3 t80 -92.59 -37.87 12.21 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.668 1.187 . . . . 0.0 111.006 172.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -66.93 -14.42 62.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.902 0.382 . . . . 0.0 111.19 178.378 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 15' ' ' GLN . 1.3 t . . . . . 0 CA--C 1.528 0.114 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -62.31 -25.22 76.4 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.825 3.017 . . . . 0.0 109.899 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -91.54 -45.41 8.52 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 113.849 -1.523 . . . . 0.0 109.821 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HG2' ' HB3' ' A' ' 12' ' ' SER . 9.9 mm-40 -70.22 -12.87 61.89 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.827 0.451 . . . . 0.0 111.507 -174.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -80.58 -13.24 59.23 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.717 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.11 -46.83 3.17 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 171.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 mt -58.35 -51.97 64.79 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 118.898 -0.572 . . . . 0.0 111.377 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.5 mt-10 -72.11 -22.27 61.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.131 -174.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 t -81.37 -33.38 32.39 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -78.65 -61.66 1.94 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.552 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -54.15 -27.26 32.4 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 112.898 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.2 m -84.24 -28.35 27.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 118.947 0.794 . . . . 0.0 111.564 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.0 tp -83.84 -16.58 43.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.742 0.417 . . . . 0.0 111.685 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 p -118.7 -1.62 11.08 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.314 0.645 . . . . 0.0 111.607 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp 63.24 12.42 6.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.353 0.408 . . . . 0.0 112.036 169.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.45 -177.36 6.17 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 122.985 0.514 . . . . 0.0 111.104 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.43 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.1 t70 -80.93 146.52 59.58 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -58.31 -7.91 4.49 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.985 3.123 . . . . 0.0 114.756 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -101.64 -11.2 19.38 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 118.381 0.537 . . . . 0.0 111.359 177.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -89.78 -37.51 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.9 p -52.06 -51.39 57.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 108.673 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.406 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 27.7 ttt85 -51.55 -53.56 36.68 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 128.133 2.573 . . . . 0.0 111.354 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -68.61 -12.43 61.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.677 0.671 . . . . 0.0 112.789 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 27.6 m-85 -102.57 -7.93 21.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 118.727 0.694 . . . . 0.0 111.041 173.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -87.63 -37.99 16.3 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 80.1 mt-30 -64.69 -12.57 47.92 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -84.09 -15.46 47.28 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.36 0.664 . . . . 0.0 111.898 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -145.43 41.7 1.25 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.921 0.489 . . . . 0.0 110.969 -173.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 24.9 p80 51.29 37.76 19.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 176.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.408 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 17.0 m95 58.34 45.51 16.82 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.901 1.28 . . . . 0.0 112.066 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -96.65 113.5 25.07 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 175.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.33 -17.5 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.129 -170.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.3 -43.06 13.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -67.06 -40.04 86.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.617 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.65 72.47 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.485 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.9 mt -73.59 -31.32 63.52 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.122 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -75.75 -37.3 59.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -71.09 -40.15 71.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.078 -0.389 . . . . 0.0 110.612 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 37.8 t80 -68.1 -40.85 82.52 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.709 -0.619 . . . . 0.0 111.555 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -71.33 -9.42 58.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.943 0.338 . . . . 0.0 110.17 176.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 CA--C 1.529 0.165 0 C-N-CA 122.448 0.299 . . . . 0.0 111.14 174.946 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.48 -25.37 70.36 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 123.986 3.124 . . . . 0.0 109.822 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -91.99 -45.88 8.1 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.154 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.0 mm-40 -69.93 -12.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.793 0.437 . . . . 0.0 111.666 -175.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -79.67 -14.63 58.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.688 177.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.54 -47.61 3.35 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.031 171.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -60.34 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.194 -178.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -73.31 -20.7 60.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 118.381 -1.328 . . . . 0.0 111.099 -175.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -81.55 -33.29 31.81 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -80.37 -58.15 3.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.681 -176.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.13 -27.44 63.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.06 0.944 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 m -83.04 -28.5 29.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.96 0.8 . . . . 0.0 111.347 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.1 tp -83.45 -14.98 51.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.7 0.4 . . . . 0.0 111.723 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.3 p -121.38 -0.66 9.79 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 123.232 0.613 . . . . 0.0 111.545 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.55 11.14 5.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 169.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.1 p -87.77 -172.27 3.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.107 0.563 . . . . 0.0 110.511 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -89.05 145.41 34.36 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 83.1 Cg_exo -51.79 -25.31 20.57 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.322 2.681 . . . . 0.0 114.483 -178.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -79.96 -17.45 52.94 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.959 0.799 . . . . 0.0 111.536 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.5 t -84.52 -35.41 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.0 t -59.18 -52.2 66.7 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.4 ttt85 -47.56 -55.9 8.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.975 1.31 . . . . 0.0 110.742 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -66.04 -20.38 66.16 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -90.57 -28.16 18.65 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-N 119.466 1.03 . . . . 0.0 109.603 175.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.64 -35.5 75.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.2 mt-30 -66.76 -15.23 63.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.2 mtm-85 -91.4 -7.52 50.51 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.589 0.356 . . . . 0.0 111.066 178.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -134.02 24.43 3.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.239 0.616 . . . . 0.0 111.227 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 53.52 31.65 12.75 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.373 0.669 . . . . 0.0 111.914 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.6 m95 60.44 34.64 20.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.723 1.209 . . . . 0.0 112.227 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -87.57 110.51 20.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tt -70.22 -16.04 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 119.436 -0.906 . . . . 0.0 111.938 -171.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -85.28 -42.41 14.66 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.67 -39.71 80.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.66 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.85 -26.89 60.81 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.89 -177.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.2 mt -75.04 -34.67 61.89 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -69.98 -32.49 70.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -71.81 -35.29 69.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -77.29 -37.83 51.94 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -63.85 -15.13 58.12 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 118.36 0.527 . . . . 0.0 109.681 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.453 -0.283 0 C-N-CA 122.421 0.288 . . . . 0.0 111.577 175.737 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.446 -0.639 0 CA-C-O 120.981 0.419 . . . . 0.0 110.668 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.9 Cg_exo -67.33 -29.06 38.96 Favored 'Trans proline' 0 N--CA 1.454 -0.829 1 C-N-CA 125.703 4.268 . . . . 0.0 111.673 -174.17 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 53.7 mt-10 -94.54 -33.33 13.09 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.728 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -74.56 -13.44 60.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 122.773 0.429 . . . . 0.0 111.038 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.71 -14.79 56.1 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -50.37 3.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.769 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.7 mt -58.95 -49.72 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 118.734 -0.65 . . . . 0.0 112.236 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.503 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.7 mt-10 -73.56 -21.12 60.45 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.054 -175.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.74 -33.34 31.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -80.82 -58.43 3.1 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 124.462 1.105 . . . . 0.0 109.643 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.503 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -58.23 -27.72 64.21 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.635 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -82.1 -28.22 32.42 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.888 0.767 . . . . 0.0 111.464 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 48.0 tp -83.12 -15.68 49.77 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 111.79 177.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.1 p -118.85 -1.54 11.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 122.927 0.491 . . . . 0.0 111.59 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 63.23 11.21 5.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.717 0.407 . . . . 0.0 111.891 169.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -92.98 -173.02 3.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.877 0.871 . . . . 0.0 110.205 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -84.79 143.67 40.96 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 122.939 0.496 . . . . 0.0 110.503 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.53 -26.75 56.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.452 2.768 . . . . 0.0 113.896 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-N 118.149 0.431 . . . . 0.0 110.989 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -87.78 -36.94 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.8 t -58.08 -48.67 79.44 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 45.6 ttt85 -47.99 -55.62 9.61 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.322 1.449 . . . . 0.0 110.642 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -70.27 -13.41 62.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -97.67 -26.12 14.87 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 119.267 0.94 . . . . 0.0 109.269 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.42 -33.14 66.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 83.1 mt-30 -68.58 -14.34 62.95 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.053 -0.404 . . . . 0.0 111.707 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -92.87 -7.59 45.81 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 123.149 0.579 . . . . 0.0 111.127 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -134.29 25.56 3.83 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.418 0.687 . . . . 0.0 111.743 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 53.71 30.53 11.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.597 0.759 . . . . 0.0 112.279 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 15.9 m95 59.53 33.77 22.25 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.918 1.287 . . . . 0.0 112.643 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -85.22 116.18 23.43 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.55 -2.018 . . . . 0.0 105.55 172.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -74.18 -16.4 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 118.94 -1.104 . . . . 0.0 111.689 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -84.88 -40.74 16.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.65 -40.34 73.1 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.964 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.49 62.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.1 mt -75.74 -36.16 60.0 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.086 0.403 . . . . 0.0 110.116 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.07 -31.01 68.4 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -70.44 -35.92 73.66 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -76.58 -37.7 56.1 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 121.763 -0.586 . . . . 0.0 111.964 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -63.68 -15.44 58.39 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.0 t70 . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 176.299 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -67.26 -25.5 42.74 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.858 3.039 . . . . 0.0 109.818 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 33.1 mt-10 -91.67 -47.15 7.54 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.252 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 13.8 mm-40 -70.56 -11.24 60.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.266 0.354 . . . . 0.0 111.628 -174.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.35 -14.3 58.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.49 -51.52 2.86 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.664 0.603 . . . . 0.0 109.922 172.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.7 mt -55.65 -48.44 77.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.919 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.08 -22.5 59.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 118.718 -1.193 . . . . 0.0 110.893 -175.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.49 -29.71 33.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -84.11 -53.7 5.34 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -57.38 -29.19 63.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.854 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 m -81.52 -26.76 34.85 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.725 0.693 . . . . 0.0 112.157 176.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 56.9 tp -90.2 -22.4 21.7 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.397 0.679 . . . . 0.0 112.297 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.7 p -109.06 -4.5 16.57 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 123.007 0.523 . . . . 0.0 111.268 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt 63.64 11.85 6.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 123.455 0.472 . . . . 0.0 111.778 168.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.6 t -97.97 -165.53 1.26 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.628 1.171 . . . . 0.0 110.056 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -84.88 152.23 59.0 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.232 0.613 . . . . 0.0 110.67 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.79 -22.66 31.64 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.403 2.735 . . . . 0.0 111.701 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.66 -16.21 57.59 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 117.862 0.301 . . . . 0.0 110.694 176.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.75 -32.4 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 175.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 52.0 m -60.51 -41.31 94.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 172.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 38.2 ttt-85 -66.61 -23.05 66.13 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 125.26 1.424 . . . . 0.0 112.608 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -99.39 -4.95 30.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 120.148 1.34 . . . . 0.0 111.642 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -107.23 -7.89 16.61 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.1 mt -88.57 -38.27 15.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 171.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 43.3 mt-30 -67.31 -6.75 20.02 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.2 mtp85 -86.57 -14.46 42.81 Favored 'General case' 0 N--CA 1.457 -0.075 0 C-N-CA 122.539 0.335 . . . . 0.0 111.702 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -146.88 37.56 0.97 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.962 0.505 . . . . 0.0 111.709 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 58.08 34.42 24.19 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.485 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.9 m95 58.55 38.33 25.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.427 1.091 . . . . 0.0 112.524 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -88.06 111.77 21.91 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 175.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.1 tt -70.19 -15.15 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 118.944 -1.102 . . . . 0.0 112.265 -169.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.06 -41.39 14.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -178.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -68.59 -42.61 77.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.47 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -34.46 77.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.854 0.862 . . . . 0.0 111.623 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.0 mt -73.24 -33.55 65.37 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.316 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -74.4 -34.12 63.2 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 118.061 0.391 . . . . 0.0 110.213 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -72.48 -41.16 66.32 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.459 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 53.8 t80 -65.4 -38.59 90.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.702 -0.624 . . . . 0.0 111.325 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -74.42 -10.84 59.97 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.168 -0.332 . . . . 0.0 110.421 174.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 . . . . . 0 N--CA 1.461 0.117 0 CA-C-N 117.652 0.206 . . . . 0.0 110.966 176.906 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.512 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.971 0.415 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.512 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.0 Cg_exo -67.01 -28.57 41.52 Favored 'Trans proline' 0 N--CA 1.454 -0.823 1 C-N-CA 125.331 4.021 . . . . 0.0 112.06 -174.215 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 68.0 mt-10 -95.37 -34.83 11.99 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.647 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -72.58 -13.31 61.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 123.498 0.499 . . . . 0.0 111.247 -176.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.05 -14.91 55.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -48.98 3.44 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 169.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.1 mt -60.46 -50.94 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.056 -175.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.11 -20.93 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.672 -1.211 . . . . 0.0 111.115 -174.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -84.19 -28.27 27.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 122.026 0.917 . . . . 0.0 108.65 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -85.62 -58.34 2.7 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.174 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -57.06 -26.14 59.86 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.093 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.4 p -79.1 -38.97 34.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 118.934 0.788 . . . . 0.0 111.627 172.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.7 tp -77.28 -12.71 59.98 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.04 0.536 . . . . 0.0 112.094 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.8 p -123.22 -0.59 8.82 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.257 0.623 . . . . 0.0 111.747 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp 62.98 10.91 4.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.4 p -88.17 -171.82 3.54 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.181 0.593 . . . . 0.0 111.084 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -87.32 146.0 38.96 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -55.9 -23.08 40.88 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.365 2.71 . . . . 0.0 113.691 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -84.72 -11.36 55.99 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.969 0.349 . . . . 0.0 111.255 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -87.87 -38.38 11.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.8 t -57.52 -45.38 85.07 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.9 ttt85 -49.31 -58.48 5.01 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.98 1.312 . . . . 0.0 110.353 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -66.25 -14.38 61.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -174.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.41 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 24.4 m-85 -100.56 -17.77 16.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.229 0.922 . . . . 0.0 110.028 175.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 mt -78.58 -35.8 45.32 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 78.8 mt-30 -65.56 -15.43 62.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.731 0.412 . . . . 0.0 111.645 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -87.15 -10.41 52.78 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 123.674 0.789 . . . . 0.0 111.218 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -140.98 33.62 1.75 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 122.734 0.414 . . . . 0.0 111.398 -172.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 p80 49.19 35.09 6.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 20.6 m95 57.32 38.68 28.64 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.245 1.418 . . . . 0.0 112.724 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.57 119.3 31.37 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.044 -1.835 . . . . 0.0 106.044 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -74.44 -18.28 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 119.024 -1.07 . . . . 0.0 111.734 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -84.87 -42.2 15.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -176.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -68.88 -38.86 79.94 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.803 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.03 -26.67 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.428 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -76.35 -33.44 58.96 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 118.025 0.375 . . . . 0.0 110.341 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -72.72 -34.12 66.89 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.147 0.43 . . . . 0.0 109.953 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -70.82 -40.23 72.58 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.07 -0.394 . . . . 0.0 110.241 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.41 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.1 t80 -66.24 -39.43 89.54 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.689 -0.632 . . . . 0.0 111.245 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -75.81 -6.52 51.1 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 122.219 -0.3 . . . . 0.0 110.674 174.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 CA--C 1.53 0.178 0 CA-C-O 120.609 0.242 . . . . 0.0 110.878 175.316 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.536 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.536 0 CA-C-O 121.071 0.462 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.5 Cg_exo -67.62 -29.87 35.8 Favored 'Trans proline' 0 N--CA 1.453 -0.853 1 C-N-CA 125.519 4.146 . . . . 0.0 111.778 -173.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 31.5 mt-10 -91.96 -32.93 15.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.356 176.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -76.71 -11.8 59.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.018 0.527 . . . . 0.0 111.16 -174.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.47 -13.18 52.75 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.96 -45.39 3.63 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 170.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.2 mt -61.17 -50.33 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.487 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.0 mt-10 -72.63 -20.74 61.22 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.967 -174.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -83.05 -32.99 26.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -80.09 -59.06 2.86 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.247 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.487 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -56.92 -27.35 60.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.212 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.1 m -82.29 -27.09 32.55 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.076 0.853 . . . . 0.0 112.076 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.7 tp -88.47 -21.03 24.41 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.198 0.599 . . . . 0.0 111.923 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -110.34 -3.2 16.3 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 123.168 0.587 . . . . 0.0 110.89 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt 63.58 12.94 6.87 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 123.647 0.592 . . . . 0.0 111.72 168.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.8 p -88.89 -165.59 1.38 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.911 0.884 . . . . 0.0 110.427 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -97.05 146.62 31.62 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 85.3 Cg_exo -53.29 -18.61 10.94 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.444 2.763 . . . . 0.0 114.257 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -82.77 -13.77 55.68 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.8 0.727 . . . . 0.0 111.846 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -92.05 -36.36 7.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -54.18 -56.58 16.83 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.9 ptp180 -57.45 -39.28 75.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.803 -174.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -73.74 -14.33 61.11 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.034 0.834 . . . . 0.0 112.787 -178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.405 ' CD2' ' NH2' ' A' ' 38' ' ' ARG . 11.0 m-85 -98.44 -26.11 14.57 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 118.762 0.71 . . . . 0.0 109.857 172.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.28 -33.93 61.29 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 70.5 mt-30 -67.35 -12.13 59.42 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.166 0.586 . . . . 0.0 111.511 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.405 ' NH2' ' CD2' ' A' ' 35' ' ' TYR . 33.2 mtm-85 -97.79 -10.39 24.89 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 122.873 0.469 . . . . 0.0 111.463 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -131.03 27.88 4.83 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.368 0.667 . . . . 0.0 110.872 -174.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 53.59 31.7 13.0 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.702 0.801 . . . . 0.0 112.125 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.472 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 16.9 m95 58.77 31.53 21.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.347 1.059 . . . . 0.0 112.378 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.53 110.69 18.87 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -70.42 -15.7 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 119.378 -0.929 . . . . 0.0 111.867 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -85.07 -42.29 14.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.74 -39.91 80.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.646 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.8 -26.03 60.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.757 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.9 -34.84 64.55 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -72.98 -27.21 61.67 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -82.63 -12.18 57.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.746 0.419 . . . . 0.0 111.761 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -98.46 -36.15 10.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.76 1.224 . . . . 0.0 110.926 172.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -71.57 -10.09 59.23 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 172.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.922 0.391 . . . . 0.0 110.434 175.279 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 111.797 0.295 . . . . 0.0 111.797 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -64.4 -25.58 63.56 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.215 3.277 . . . . 0.0 110.063 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -90.52 -45.34 9.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.388 -1.733 . . . . 0.0 109.914 177.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.75 -15.63 62.7 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.007 0.523 . . . . 0.0 110.894 -173.138 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.62 -13.53 60.06 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.95 -56.74 2.33 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.077 170.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -51.91 -51.21 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 C-N-CA 123.395 0.678 . . . . 0.0 112.411 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.2 mt-10 -75.55 -20.32 58.74 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 118.153 -1.419 . . . . 0.0 111.127 -173.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.6 t -80.89 -32.35 34.84 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -80.96 -59.22 2.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.6 1.16 . . . . 0.0 109.307 -174.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.48 -28.61 60.21 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.505 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.2 m -81.93 -26.09 34.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.836 0.744 . . . . 0.0 111.776 175.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.75 -23.3 25.52 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.13 0.572 . . . . 0.0 111.87 178.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.9 p -107.6 -3.98 18.76 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.066 0.546 . . . . 0.0 110.791 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt 63.67 12.27 6.44 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.658 0.383 . . . . 0.0 111.473 169.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -94.44 -167.89 1.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.401 1.08 . . . . 0.0 110.792 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -88.17 142.09 31.53 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.034 0.934 . . . . 0.0 109.423 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -64.98 -17.05 58.34 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.276 2.651 . . . . 0.0 113.187 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 11.2 mmpt? -83.22 -9.92 58.87 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.394 0.543 . . . . 0.0 110.329 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -91.86 -35.2 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -57.49 -46.54 83.6 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 76.4 ttt-85 -47.52 -58.45 4.2 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 125.316 1.446 . . . . 0.0 110.052 175.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -68.78 -11.74 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -175.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 19.5 m-85 -102.77 -17.01 15.78 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.398 0.999 . . . . 0.0 109.714 174.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.9 mt -80.07 -35.69 36.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 80.6 mt-30 -65.96 -17.09 64.44 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.761 0.425 . . . . 0.0 111.389 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.3 mtp85 -83.45 -9.52 58.95 Favored 'General case' 0 C--O 1.23 0.042 0 C-N-CA 123.502 0.721 . . . . 0.0 111.062 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -142.01 27.7 1.78 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 54.41 31.34 14.4 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.36 0.664 . . . . 0.0 112.402 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 14.9 m95 60.16 34.5 21.13 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.795 1.238 . . . . 0.0 112.621 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.98 116.91 25.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 172.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -73.29 -17.6 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 118.913 -1.115 . . . . 0.0 111.677 -169.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.59 -42.32 15.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.84 -39.57 79.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.595 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.4 -27.06 62.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.607 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.8 mt -76.08 -33.88 59.53 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.259 0.481 . . . . 0.0 110.508 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -71.66 -35.34 70.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -70.97 -41.38 71.12 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 59.7 t80 -65.24 -39.1 92.26 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 121.635 -0.666 . . . . 0.0 111.182 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -77.14 -4.95 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.389 -0.195 . . . . 0.0 110.782 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.529 0.168 0 CA-C-N 117.708 0.231 . . . . 0.0 111.001 174.86 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.539 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.445 -0.682 0 CA-C-O 120.936 0.398 . . . . 0.0 110.106 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.5 Cg_exo -67.88 -30.46 33.19 Favored 'Trans proline' 0 N--CA 1.455 -0.785 1 C-N-CA 125.51 4.14 . . . . 0.0 111.166 -175.159 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -88.66 -38.54 14.71 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.477 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 -8.22 57.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -171.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.52 -12.87 53.38 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.88 -49.82 2.85 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.304 170.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.07 -52.47 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 CA-C-N 118.648 0.658 . . . . 0.0 112.282 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.563 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.55 -20.62 59.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 118.387 -1.325 . . . . 0.0 110.803 -172.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 t -80.89 -33.46 34.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -78.25 -63.42 1.4 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.485 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -52.67 -27.65 18.25 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.304 1.041 . . . . 0.0 112.917 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m -84.2 -28.05 27.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.277 0.944 . . . . 0.0 112.039 174.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.82 -18.97 35.82 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.028 0.531 . . . . 0.0 111.473 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.2 p -116.83 -1.87 11.95 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.36 12.33 6.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.542 0.526 . . . . 0.0 112.357 169.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.0 p -86.03 -175.37 5.53 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.956 0.503 . . . . 0.0 110.886 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.446 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.3 t70 -83.55 145.82 48.72 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 53.4 Cg_exo -57.81 -9.29 5.52 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.796 2.997 . . . . 0.0 114.749 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -99.25 -12.71 20.14 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.597 0.635 . . . . 0.0 111.473 177.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -89.47 -38.13 10.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.7 p -54.36 -49.5 69.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.083 0.944 . . . . 0.0 108.601 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 20.3 ttt85 -53.74 -52.36 60.39 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.982 2.513 . . . . 0.0 111.618 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -67.76 -18.01 64.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.694 0.679 . . . . 0.0 112.456 -177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.439 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 22.4 m-85 -95.05 -20.41 19.35 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.041 0.837 . . . . 0.0 110.25 174.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.5 mp -75.36 -39.15 59.59 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.1 mt-30 -64.45 -18.72 65.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.169 0.588 . . . . 0.0 111.717 178.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.5 mtp85 -81.12 -9.44 59.81 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.373 0.669 . . . . 0.0 111.174 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -140.52 27.55 2.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.634 0.374 . . . . 0.0 111.839 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 53.9 33.39 17.12 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.549 0.74 . . . . 0.0 112.116 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.7 m95 59.87 31.6 20.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.519 1.128 . . . . 0.0 112.67 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -86.6 112.08 21.25 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tt -69.75 -16.97 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.912 -170.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -85.26 -42.75 14.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -177.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.55 -38.88 81.18 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.6 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.66 -26.94 61.82 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.6 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -74.22 -34.31 63.65 Favored 'General case' 0 C--N 1.338 0.078 0 CA-C-N 118.222 0.465 . . . . 0.0 109.935 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -71.48 -35.79 70.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.154 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -70.93 -42.09 70.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.3 t80 -66.38 -38.65 88.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.574 -0.704 . . . . 0.0 111.424 177.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -76.78 -5.68 49.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.555 0.161 . . . . 0.0 110.818 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 CA--C 1.529 0.154 0 CA-C-N 117.925 0.33 . . . . 0.0 111.215 175.374 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.275 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -63.52 -25.45 70.06 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.958 3.105 . . . . 0.0 110.009 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -90.73 -45.92 8.56 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 113.625 -1.625 . . . . 0.0 109.885 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.73 -16.19 62.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.171 0.588 . . . . 0.0 110.88 -172.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.42 -14.0 60.09 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.81 -54.55 2.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 123.644 0.59 . . . . 0.0 110.176 171.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 mt -52.78 -53.3 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-O 118.737 -0.649 . . . . 0.0 112.267 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.556 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.3 mt-10 -73.18 -21.26 60.72 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 118.088 -1.445 . . . . 0.0 111.072 -173.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.0 t -81.46 -29.6 33.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -85.34 -56.96 3.27 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.153 0.981 . . . . 0.0 109.542 -174.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.556 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -57.06 -27.43 61.69 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.293 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -83.6 -30.33 27.05 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 119.076 0.853 . . . . 0.0 111.533 174.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -81.4 -16.09 53.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.855 0.462 . . . . 0.0 111.325 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -120.11 -1.28 10.37 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.558 0.743 . . . . 0.0 111.705 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp 63.05 10.07 4.23 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.455 0.472 . . . . 0.0 112.242 169.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.5 p -89.33 -172.44 3.62 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.183 0.593 . . . . 0.0 110.925 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -86.94 145.19 37.96 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -55.22 -23.16 35.63 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.387 2.725 . . . . 0.0 113.864 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -83.97 -12.5 55.22 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.026 0.375 . . . . 0.0 111.127 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.7 t -86.48 -38.65 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.5 t -57.71 -47.1 83.32 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.479 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 74.1 ttt-85 -53.52 -23.88 11.76 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 125.072 1.349 . . . . 0.0 112.263 177.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -99.94 -11.04 21.0 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 120.419 1.463 . . . . 0.0 112.315 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.432 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 40.3 m-85 -102.0 -7.36 22.43 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.082 0.401 . . . . 0.0 109.974 171.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.435 HD23 ' CE3' ' A' ' 41' ' ' TRP . 4.7 mp -86.9 -41.98 13.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 77.0 mt-30 -64.74 -10.43 27.45 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -76.81 -21.85 54.49 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.719 0.808 . . . . 0.0 111.372 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -144.45 35.73 1.19 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.137 0.575 . . . . 0.0 112.399 -171.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 57.55 36.16 26.56 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CE3' HD23 ' A' ' 36' ' ' LEU . 17.0 m95 60.13 46.0 11.09 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.009 0.923 . . . . 0.0 112.602 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -98.68 111.05 23.55 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 175.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 tt -67.06 -17.83 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 120.237 -0.585 . . . . 0.0 112.15 -171.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -86.68 -44.02 12.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.347 -0.845 . . . . 0.0 108.896 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.4 m-30 -66.45 -38.54 87.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.537 177.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.37 -30.74 68.8 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.265 0.626 . . . . 0.0 112.004 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -72.73 -31.54 65.04 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.777 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -74.6 -36.77 62.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.16 -44.37 72.4 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 117.803 0.274 . . . . 0.0 110.609 -179.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.432 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 30.3 t80 -68.85 -36.63 78.37 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.694 -0.629 . . . . 0.0 111.506 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -74.88 -7.92 54.94 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.061 -0.399 . . . . 0.0 110.282 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 122.084 0.154 . . . . 0.0 111.15 174.968 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER . . . . . 0 CA--C 1.533 0.291 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -63.76 -26.53 68.07 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 124.003 3.135 . . . . 0.0 109.917 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.424 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 52.4 mt-10 -89.07 -47.51 8.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.169 -1.832 . . . . 0.0 109.892 177.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.593 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.25 -16.27 63.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.753 0.658 . . . . 0.0 111.157 -172.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.9 -12.34 59.94 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.95 -51.64 2.77 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.617 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 mt -54.84 -53.15 35.84 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 118.713 -0.661 . . . . 0.0 111.628 -178.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.5 mt-10 -73.93 -20.78 60.28 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.203 -172.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -82.3 -28.62 31.6 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -84.15 -63.81 1.28 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.925 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -49.63 -28.23 5.58 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.341 1.057 . . . . 0.0 112.733 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.3 p -79.51 -39.55 31.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.27 0.941 . . . . 0.0 111.803 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.0 tp -78.19 -18.74 55.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.471 0.709 . . . . 0.0 111.983 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.0 p -111.13 -3.04 15.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.273 0.629 . . . . 0.0 110.801 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 63.82 11.59 6.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.543 0.527 . . . . 0.0 111.935 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -94.49 -174.44 3.33 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.941 0.497 . . . . 0.0 111.606 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -80.94 151.41 70.48 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.098 0.559 . . . . 0.0 111.055 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.88 -2.18 9.82 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.983 3.122 . . . . 0.0 112.217 -177.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -102.37 -7.8 21.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.2 0.6 . . . . 0.0 111.07 175.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.3 t -102.54 -35.28 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.097 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -51.18 -47.81 62.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 122.656 1.217 . . . . 0.0 108.816 172.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -54.82 -52.32 63.07 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 128.757 2.823 . . . . 0.0 112.058 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.05 -14.35 61.84 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.59 0.632 . . . . 0.0 112.474 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.4 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 32.1 m-85 -98.33 -5.3 33.15 Favored 'General case' 0 C--N 1.337 0.037 0 C-N-CA 123.255 0.622 . . . . 0.0 110.233 172.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.0 mp -93.31 -48.15 6.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 173.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -55.86 -25.1 40.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.956 0.502 . . . . 0.0 110.89 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.286 20.3 ttm180 -65.1 -20.64 66.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.988 2.515 . . . . 0.0 113.64 -178.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -144.56 29.95 1.24 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.975 0.91 . . . . 0.0 110.217 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 61.82 36.6 15.99 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.061 0.545 . . . . 0.0 112.059 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.424 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.8 m95 61.05 42.71 12.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.854 1.261 . . . . 0.0 111.884 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -95.35 112.48 24.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.93 -16.71 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.886 -171.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.77 -43.28 12.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -67.12 -39.23 86.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.601 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.4 -31.17 70.33 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.808 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.39 -28.2 60.99 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.906 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.85 -38.4 53.83 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.159 176.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.36 -41.75 66.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.916 -0.49 . . . . 0.0 110.995 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.4 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 43.8 t80 -68.3 -36.66 79.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 121.581 -0.699 . . . . 0.0 111.375 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -74.97 -9.16 58.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.531 0.239 0 CA-C-N 117.61 0.187 . . . . 0.0 111.018 174.645 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.557 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.765 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -74.15 -27.37 11.81 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.307 2.672 . . . . 0.0 110.513 172.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.407 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 47.5 mt-10 -89.14 -46.37 8.87 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.837 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.9 OUTLIER -70.46 -13.94 62.33 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 125.022 1.329 . . . . 0.0 110.223 -172.039 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -81.43 -12.31 58.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.19 -50.5 2.9 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.281 169.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.7 mt -56.06 -51.94 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HA ' HG22 ' A' ' 22' ' ' THR . 20.0 mt-10 -74.99 -19.64 60.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 118.514 -1.274 . . . . 0.0 110.775 -173.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -82.1 -32.31 30.28 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -81.58 -56.26 4.13 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.783 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.547 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -58.27 -28.69 65.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.409 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -82.92 -26.32 31.59 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 118.856 0.753 . . . . 0.0 111.629 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.4 tp -86.49 -18.65 31.08 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.097 0.559 . . . . 0.0 111.686 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -111.28 -4.17 15.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.149 0.58 . . . . 0.0 111.228 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt 63.4 10.35 4.73 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.558 0.536 . . . . 0.0 111.642 169.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 t -95.04 -170.73 2.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.967 0.907 . . . . 0.0 110.569 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.71 144.65 42.77 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.149 0.58 . . . . 0.0 110.454 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -56.06 -24.45 49.17 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.652 2.901 . . . . 0.0 114.098 -177.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -81.51 -18.8 43.81 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 117.901 0.319 . . . . 0.0 110.481 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -81.99 -34.62 12.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.1 t -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 57.0 ttt85 -47.63 -54.88 10.64 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.541 1.136 . . . . 0.0 110.767 177.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -66.59 -18.79 65.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -176.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -94.58 -21.75 18.64 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.462 1.028 . . . . 0.0 109.976 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 mp -74.18 -37.2 64.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 78.0 mt-30 -66.84 -16.67 64.45 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.124 -0.36 . . . . 0.0 111.801 177.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -84.13 -9.55 58.49 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.183 0.593 . . . . 0.0 110.912 177.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -141.45 26.84 1.93 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.796 0.439 . . . . 0.0 111.706 -171.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 53.62 33.01 15.53 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.605 0.762 . . . . 0.0 112.533 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.407 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 16.2 m95 60.44 33.6 20.63 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.533 1.133 . . . . 0.0 112.379 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -88.82 110.77 21.32 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 172.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.5 tt -69.46 -16.58 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 C-N-CA 119.758 -0.777 . . . . 0.0 112.23 -171.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -85.04 -42.79 14.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.7 -39.74 80.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.815 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.9 -27.66 62.01 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.68 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.1 mt -75.63 -33.59 60.51 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -70.08 -37.46 75.45 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -70.94 -32.14 68.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.298 -0.251 . . . . 0.0 110.713 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -80.6 -35.73 33.73 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.479 -0.763 . . . . 0.0 111.758 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.34 -12.75 45.3 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.2 t70 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 175.272 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -66.67 -25.66 46.66 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 124.21 3.274 . . . . 0.0 110.039 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 41.4 mt-10 -90.93 -47.35 7.64 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 113.41 -1.723 . . . . 0.0 109.873 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.618 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.12 -14.06 62.48 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.42 0.688 . . . . 0.0 110.828 -173.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.25 -14.61 59.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.77 -56.68 2.33 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.052 170.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.1 mt -52.24 -50.08 38.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.57 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.9 mt-10 -76.16 -20.31 57.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 118.272 -1.371 . . . . 0.0 110.695 -174.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -82.41 -26.97 32.3 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -87.1 -52.7 5.28 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -174.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.57 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.9 t -58.87 -30.15 67.52 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.195 178.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -84.23 -28.54 27.19 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.834 0.743 . . . . 0.0 111.992 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.4 tt -84.33 -22.57 30.57 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.094 -0.379 . . . . 0.0 111.209 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.3 p -112.59 -3.23 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.298 0.639 . . . . 0.0 111.77 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp 63.89 9.24 4.37 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.481 0.488 . . . . 0.0 112.032 169.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 t -90.19 -168.86 2.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.991 0.916 . . . . 0.0 109.934 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -86.6 144.38 37.44 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 122.893 0.477 . . . . 0.0 110.365 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -56.97 -26.55 68.67 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.445 2.763 . . . . 0.0 113.498 -177.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -79.51 -18.89 50.95 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.15 0.432 . . . . 0.0 110.797 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.0 t -82.81 -33.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.0 m -60.2 -46.77 88.61 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.5 ttt-85 -60.47 -37.54 81.33 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 125.479 1.512 . . . . 0.0 112.088 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -86.19 -8.2 57.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 119.519 1.054 . . . . 0.0 113.114 -175.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.407 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 14.8 m-85 -99.73 -22.64 15.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 24.7 mt -75.47 -34.85 60.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.458 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 50.6 mt-30 -68.33 -11.89 60.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -94.98 -5.56 44.37 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.796 0.438 . . . . 0.0 110.955 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -136.84 27.26 2.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.528 0.731 . . . . 0.0 111.408 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 54.39 31.32 14.32 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.661 0.784 . . . . 0.0 112.35 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.1 m95 58.97 31.85 21.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.532 1.133 . . . . 0.0 112.649 -178.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.93 117.41 23.91 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 173.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tt -73.62 -17.1 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 118.802 -1.159 . . . . 0.0 112.013 -169.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -85.68 -41.89 14.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.83 -40.15 79.62 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.683 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.14 -27.78 62.83 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.541 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.6 mt -75.53 -31.63 60.17 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.361 177.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -72.94 -31.7 64.77 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.069 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -71.94 -34.79 69.31 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 56.5 t80 -71.65 -44.84 63.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.796 -0.565 . . . . 0.0 111.268 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -64.89 -16.28 63.04 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 117.814 0.279 . . . . 0.0 110.39 176.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.5 t70 . . . . . 0 N--CA 1.455 -0.191 0 C-N-CA 122.636 0.374 . . . . 0.0 110.777 177.562 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.489 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.1 t . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -63.5 -25.98 70.13 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.805 3.004 . . . . 0.0 110.043 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 32.9 mt-10 -91.36 -46.37 8.06 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.796 -1.547 . . . . 0.0 109.773 177.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.6 mm-40 -70.37 -12.5 61.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 123.343 0.402 . . . . 0.0 111.796 -174.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -79.36 -15.18 58.32 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.25 -51.56 2.86 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.794 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.6 mt -56.16 -48.93 78.51 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.948 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' HG22 ' A' ' 22' ' ' THR . 16.7 mt-10 -75.67 -21.25 57.81 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.374 -175.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 t -81.3 -34.68 31.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -76.3 -62.33 1.65 Allowed 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.111 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.535 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -54.44 -29.66 50.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.867 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -81.2 -25.64 36.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 119.056 0.844 . . . . 0.0 112.073 175.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.6 tp -89.97 -22.53 21.89 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.927 0.491 . . . . 0.0 112.077 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.6 p -109.02 -3.75 17.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.238 0.615 . . . . 0.0 111.056 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt 63.51 13.5 7.25 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.707 0.403 . . . . 0.0 111.854 168.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.7 p -87.38 -169.5 2.64 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.627 0.771 . . . . 0.0 110.65 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.458 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.5 t70 -88.15 144.39 34.29 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -59.29 -7.93 5.9 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.995 3.13 . . . . 0.0 114.683 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.552 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 10.7 mmpt? -97.95 -10.76 23.98 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.657 0.662 . . . . 0.0 111.208 176.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -91.53 -38.72 10.86 Favored 'Isoleucine or valine' 0 C--N 1.337 0.06 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -53.4 -44.03 68.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 122.324 1.059 . . . . 0.0 109.157 174.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 62.8 ttt-85 -63.85 -33.14 75.02 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.101 2.56 . . . . 0.0 112.066 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -88.73 -9.87 50.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 119.224 0.92 . . . . 0.0 112.522 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -97.58 -24.64 15.46 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.2 -35.56 63.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.2 mt-30 -67.38 -12.81 61.15 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -94.63 -7.6 40.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.981 0.513 . . . . 0.0 111.348 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -133.41 27.18 4.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.291 0.636 . . . . 0.0 111.144 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 53.21 31.16 11.06 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.668 0.787 . . . . 0.0 112.223 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.7 m95 58.43 33.21 22.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.593 1.157 . . . . 0.0 112.275 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.07 116.01 22.65 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.21 -16.96 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.929 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.04 -41.18 16.03 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -69.74 -40.37 76.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.679 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.48 -27.68 62.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 122.703 0.401 . . . . 0.0 111.364 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.68 -34.31 64.83 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -73.11 -30.52 63.7 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -17.52 59.38 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 122.579 0.352 . . . . 0.0 111.759 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.28 -36.17 11.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.477 1.111 . . . . 0.0 111.621 174.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -75.05 -5.13 42.43 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.239 -0.288 . . . . 0.0 110.372 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 CA--C 1.528 0.122 0 C-N-CA 122.677 0.391 . . . . 0.0 111.122 175.252 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.471 0 CA-C-O 121.259 0.552 . . . . 0.0 110.726 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 90.3 Cg_endo -83.43 -21.11 4.53 Favored 'Trans proline' 0 N--CA 1.451 -1.0 1 C-N-CA 125.534 4.156 . . . . 0.0 109.805 -168.142 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.509 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 20.9 mt-10 -98.81 -28.21 13.59 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.312 175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.523 HE21 ' N ' ' A' ' 15' ' ' GLN . 1.2 mm-40 -79.07 -14.38 59.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -175.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -81.05 -11.18 59.57 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' PHE . . . -112.67 -49.16 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.072 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.42 -47.93 88.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 CA-C-N 118.843 0.747 . . . . 0.0 111.77 -178.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.3 mt-10 -75.14 -20.3 59.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.827 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -84.41 -28.9 26.59 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 17' ' ' ALA . 27.7 t80 -83.66 -54.12 5.16 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -175.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.3 t -56.71 -30.37 63.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.424 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.8 m -83.4 -26.95 29.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 0.77 . . . . 0.0 111.811 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.4 tp -87.24 -16.41 35.32 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.0 p -119.95 -1.49 10.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 122.806 0.442 . . . . 0.0 111.721 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.96 10.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 169.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.04 -168.58 2.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.159 0.584 . . . . 0.0 110.355 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -87.79 143.88 34.2 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 77.6 Cg_exo -55.61 -24.06 43.27 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.303 2.669 . . . . 0.0 113.71 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -78.68 -19.25 52.93 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 121.867 -0.52 . . . . 0.0 110.738 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -82.66 -32.67 10.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 175.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.2 m -62.5 -47.35 84.35 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.481 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 46.3 ttt85 -57.5 -39.18 75.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 111.948 178.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -81.26 -19.06 43.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 119.527 1.058 . . . . 0.0 113.234 -177.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.63 -24.61 19.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 119.258 0.935 . . . . 0.0 109.861 176.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mp -70.19 -36.8 74.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.7 mt-30 -67.57 -12.61 60.78 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -93.8 -7.06 44.49 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.169 0.588 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -134.47 25.51 3.77 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.252 0.621 . . . . 0.0 111.337 -175.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 54.08 31.62 14.12 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.363 0.665 . . . . 0.0 111.729 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.509 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 14.5 m95 59.24 32.84 22.31 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.816 1.246 . . . . 0.0 112.416 -177.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.3 110.76 19.31 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.4 tt -69.45 -16.61 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.031 -170.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.62 -42.57 14.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.13 -39.38 82.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.488 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.83 61.01 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.598 -177.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.1 mt -73.18 -33.35 65.38 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -72.09 -32.91 67.46 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -70.02 -37.68 75.68 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.344 -0.223 . . . . 0.0 110.457 178.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -73.26 -41.04 64.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.845 -0.534 . . . . 0.0 111.657 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.12 -9.48 55.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.093 0.406 . . . . 0.0 110.37 175.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.7 t70 . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 122.838 0.455 . . . . 0.0 110.662 175.292 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.54 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.134 0.492 . . . . 0.0 110.877 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.54 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.9 Cg_exo -66.98 -30.54 39.13 Favored 'Trans proline' 0 N--CA 1.456 -0.716 1 C-N-CA 125.479 4.119 . . . . 0.0 111.898 -173.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.468 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 57.7 mt-10 -92.7 -35.27 13.57 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.349 176.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -75.14 -8.44 56.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.13 0.572 . . . . 0.0 111.399 -175.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.95 -14.68 43.96 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.02 -47.7 3.39 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.768 171.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.6 mt -58.16 -51.81 66.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.706 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.477 ' HA ' HG22 ' A' ' 22' ' ' THR . 23.5 mt-10 -70.8 -23.39 62.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 118.779 -1.168 . . . . 0.0 111.164 -175.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.2 t -81.04 -34.29 32.92 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -79.12 -61.3 2.06 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.403 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.477 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.5 t -53.75 -28.73 36.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.079 0.951 . . . . 0.0 112.618 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.5 m -83.31 -28.08 29.32 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 119.078 0.854 . . . . 0.0 111.812 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 tp -84.28 -16.7 42.18 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.055 0.542 . . . . 0.0 111.781 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.4 p -118.51 -2.04 11.1 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 122.875 0.47 . . . . 0.0 111.752 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp 63.23 10.4 4.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 169.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -89.17 -174.55 4.47 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.812 0.445 . . . . 0.0 110.745 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -80.92 150.46 69.01 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 122.271 0.228 . . . . 0.0 110.89 178.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.4 -22.55 50.71 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -86.72 -10.08 54.5 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -97.85 -36.34 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.8 p -54.9 -36.97 65.76 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 122.341 1.067 . . . . 0.0 109.411 174.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 31.4 ttt85 -67.73 -54.16 21.61 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 127.909 2.483 . . . . 0.0 110.942 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -67.29 -10.0 46.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 28.5 m-85 -105.24 -9.3 17.77 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.65 0.659 . . . . 0.0 110.442 174.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -86.44 -38.77 17.0 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.411 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 81.3 mt-30 -63.7 -16.26 60.61 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.334 0.654 . . . . 0.0 112.761 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -78.32 -15.86 58.3 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.037 0.535 . . . . 0.0 111.605 -178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -143.67 36.52 1.31 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.746 0.419 . . . . 0.0 111.812 -173.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 57.66 33.34 23.11 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 13.9 m95 60.52 39.74 17.77 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.323 1.049 . . . . 0.0 112.306 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -89.6 111.18 22.05 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 174.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -68.19 -16.59 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.932 -169.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.17 -42.33 13.93 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.71 -41.29 83.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.817 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.83 74.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.748 0.819 . . . . 0.0 111.63 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.07 -33.49 63.69 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.148 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.8 -36.7 65.03 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.058 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.64 -43.52 76.14 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.8 t80 -64.06 -41.3 97.4 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.954 -0.466 . . . . 0.0 111.27 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -72.06 -4.07 26.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.171 0.189 . . . . 0.0 111.031 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.533 0.294 0 O-C-N 122.401 -0.187 . . . . 0.0 111.343 173.598 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -62.09 -25.72 77.59 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.134 3.222 . . . . 0.0 109.69 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.445 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 44.9 mt-10 -90.15 -43.96 10.1 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.877 177.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.576 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -73.24 -15.75 61.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.644 0.59 . . . . 0.0 110.926 -172.037 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -76.47 -13.29 60.11 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.07 -54.56 2.6 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.094 170.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.409 ' O ' HG22 ' A' ' 22' ' ' THR . 11.3 mt -53.44 -52.26 33.96 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.58 0 CA-C-O 118.854 -0.593 . . . . 0.0 112.181 -178.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.551 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.7 mt-10 -74.07 -21.0 60.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.936 -173.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -80.18 -33.39 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -80.74 -59.51 2.65 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.207 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.551 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -55.62 -28.84 57.51 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.377 1.071 . . . . 0.0 112.323 179.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 m -82.05 -26.24 33.9 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.2 0.909 . . . . 0.0 111.898 174.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -86.87 -22.69 25.6 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.133 0.573 . . . . 0.0 112.051 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -109.0 -3.52 17.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 123.509 0.724 . . . . 0.0 110.864 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt 64.0 12.34 6.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.421 0.451 . . . . 0.0 112.121 168.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -90.02 -165.23 1.3 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.43 0.692 . . . . 0.0 111.041 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -92.7 145.01 29.54 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.16 0.584 . . . . 0.0 109.628 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.09 -25.59 46.15 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.423 2.749 . . . . 0.0 113.807 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.4 -11.73 59.66 Favored 'General case' 0 C--O 1.228 -0.071 0 CA-C-N 118.147 0.431 . . . . 0.0 111.203 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -90.74 -37.53 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.1 t -58.35 -44.67 88.85 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.6 ttt85 -48.87 -58.28 5.09 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 125.066 1.346 . . . . 0.0 110.603 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -68.18 -13.4 62.21 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 21.3 m-85 -100.97 -18.03 16.5 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.225 0.921 . . . . 0.0 110.118 175.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.2 mt -79.67 -35.28 39.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 80.4 mt-30 -66.05 -17.22 64.55 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.507 0.323 . . . . 0.0 111.461 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 -83.0 -10.18 58.91 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.385 0.674 . . . . 0.0 110.941 177.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -141.28 27.91 1.89 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.7 0.4 . . . . 0.0 111.864 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 54.32 31.25 14.0 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.518 0.727 . . . . 0.0 112.283 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.5 m95 60.09 34.31 21.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.52 1.128 . . . . 0.0 112.827 -178.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -86.91 116.39 24.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -72.74 -17.37 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 118.958 -1.097 . . . . 0.0 111.898 -170.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.79 -42.27 15.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -68.97 -39.76 79.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.63 63.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.432 -177.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 31.0 mt -75.71 -33.78 60.34 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 118.014 0.37 . . . . 0.0 110.191 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -71.79 -35.34 69.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.234 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.28 -42.86 71.55 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.707 0.289 . . . . 0.0 110.35 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.417 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 47.2 t80 -64.43 -38.49 91.21 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.548 -0.72 . . . . 0.0 111.408 177.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -77.57 -5.6 50.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.256 0.222 . . . . 0.0 110.841 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-N 117.777 0.262 . . . . 0.0 111.206 174.837 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.1 mt . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -64.44 121.07 13.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.418 175.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -90.1 29.57 1.21 Allowed 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.486 1.114 . . . . 0.0 111.085 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 52.26 18.78 0.95 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 125.64 1.576 . . . . 0.0 113.581 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -158.57 -38.75 0.06 Allowed 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 122.53 0.332 . . . . 0.0 111.746 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.88 101.77 1.64 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 122.146 0.974 . . . . 0.0 110.498 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.9 OUTLIER -50.67 165.53 0.35 Allowed Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 113.69 -1.595 . . . . 0.0 111.495 170.405 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -64.29 -24.92 64.7 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.856 3.037 . . . . 0.0 109.927 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -92.55 -45.75 7.96 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.104 176.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.4 mm-40 -69.41 -13.49 62.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.0 0.52 . . . . 0.0 111.727 -175.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -78.94 -14.47 59.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.73 -49.77 3.11 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 171.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt -58.6 -50.72 78.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.103 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.69 -20.97 61.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.571 -1.252 . . . . 0.0 111.201 -175.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.1 t -82.51 -32.16 28.87 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -81.33 -58.18 3.16 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.3 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.519 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -58.38 -26.88 63.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.031 0.932 . . . . 0.0 112.567 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.9 m -83.03 -28.49 29.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 118.711 0.687 . . . . 0.0 111.562 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.5 tp -83.95 -14.91 49.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.023 0.529 . . . . 0.0 111.757 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 p -121.91 -0.72 9.5 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.299 0.639 . . . . 0.0 111.927 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.7 mmtp 63.45 11.77 5.83 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 169.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.3 p -86.99 -172.57 4.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 122.979 0.512 . . . . 0.0 110.652 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.0 t70 -86.15 145.58 40.81 Favored Pre-proline 0 CA--C 1.533 0.296 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 74.4 Cg_exo -54.6 -23.81 34.02 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 123.309 2.673 . . . . 0.0 113.845 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -83.85 -12.12 56.0 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 122.494 0.318 . . . . 0.0 111.277 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.04 -39.04 13.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.0 t -57.81 -44.68 86.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 174.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 75.9 ttt-85 -55.66 -23.88 30.67 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.912 1.285 . . . . 0.0 112.091 176.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -102.5 -6.51 22.81 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 120.052 1.296 . . . . 0.0 112.679 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -103.06 -16.22 15.84 Favored 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 170.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 43.8 mt -80.21 -39.58 28.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.463 -0.939 . . . . 0.0 108.463 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 40.8 mt-30 -68.0 -11.85 59.66 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 176.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -87.49 -12.78 44.96 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.631 0.372 . . . . 0.0 111.127 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -141.23 36.29 1.71 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 122.832 0.453 . . . . 0.0 111.37 -171.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 47.75 42.33 15.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 112.327 176.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.423 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 26.6 m95 50.86 35.77 13.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.524 1.53 . . . . 0.0 112.925 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -91.65 118.17 30.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 174.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 tt -73.84 -18.16 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.805 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -84.75 -41.77 15.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -70.67 -36.94 73.58 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.81 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.14 -26.83 61.36 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.523 0.329 . . . . 0.0 111.364 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.4 mt -76.63 -34.75 58.31 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-N 117.967 0.349 . . . . 0.0 110.392 178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -71.04 -34.37 71.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.599 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.1 t70 -70.87 -40.38 72.31 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 122.2 -0.313 . . . . 0.0 110.274 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.411 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 28.2 t80 -68.95 -37.63 78.94 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 121.554 -0.716 . . . . 0.0 111.02 177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -73.19 -8.98 58.16 Favored 'General case' 0 N--CA 1.453 -0.28 0 O-C-N 122.288 -0.257 . . . . 0.0 110.35 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -92.33 -11.94 33.75 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.24 0.216 . . . . 0.0 111.063 175.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -111.74 -38.83 4.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 123.126 0.57 . . . . 0.0 111.963 -175.818 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -105.56 -37.79 6.66 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 122.985 0.514 . . . . 0.0 111.85 -172.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -96.06 -15.37 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.021 0.528 . . . . 0.0 110.954 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -76.47 8.41 26.72 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.741 0.686 . . . . 0.0 113.239 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.7 t -128.23 26.7 5.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 117.788 0.794 . . . . 0.0 111.405 -177.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -66.88 -24.57 66.13 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 -176.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 74.2 p -74.37 32.44 0.09 Allowed 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -175.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -85.42 -0.2 54.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.891 0.853 . . . . 0.0 111.51 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -131.13 24.63 4.91 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.067 1.347 . . . . 0.0 111.006 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.1 t . . . . . 0 C--O 1.253 1.257 0 CA-C-O 117.097 -1.43 . . . . 0.0 110.104 -177.01 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 39.1 mm . . . . . 0 C--O 1.232 0.16 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -84.08 133.25 34.65 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.199 0.523 . . . . 0.0 110.26 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.85 57.35 1.81 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.744 1.217 . . . . 0.0 111.022 -174.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -72.39 45.15 0.13 Allowed 'General case' 0 C--N 1.335 -0.04 0 C-N-CA 126.204 1.802 . . . . 0.0 112.855 -174.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -143.5 -38.96 0.32 Allowed 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 122.765 0.426 . . . . 0.0 110.361 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -171.5 77.99 0.06 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 122.003 0.906 . . . . 0.0 109.685 177.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -60.58 -178.82 0.17 Allowed Pre-proline 0 N--CA 1.447 -0.578 0 C-N-CA 125.337 1.455 . . . . 0.0 110.195 171.131 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.8 Cg_exo -68.01 -28.89 34.73 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.338 4.025 . . . . 0.0 111.924 -174.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 30.6 mt-10 -93.29 -32.98 14.11 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.457 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.81 -15.8 61.17 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.157 0.583 . . . . 0.0 111.034 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -80.25 -13.67 59.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -107.5 -49.1 3.31 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.653 169.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.9 mt -60.21 -49.55 83.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.169 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.0 mt-10 -72.98 -21.14 60.89 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.123 -175.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -81.87 -33.31 30.63 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -80.48 -59.29 2.75 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.617 -1.174 . . . . 0.0 109.707 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -56.26 -29.1 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.436 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -82.01 -28.26 32.65 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.113 0.87 . . . . 0.0 111.819 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.9 tp -83.65 -17.54 41.15 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.741 0.416 . . . . 0.0 111.92 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.3 p -121.23 -0.33 9.94 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 122.999 0.519 . . . . 0.0 111.675 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.1 11.75 5.47 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 169.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.4 p -86.73 -169.7 2.75 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.222 0.609 . . . . 0.0 111.098 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 12.8 t70 -88.87 145.14 34.12 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 75.9 Cg_exo -54.07 -24.2 31.88 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.529 2.82 . . . . 0.0 114.136 -177.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 -16.97 45.78 Favored 'General case' 0 CA--C 1.522 -0.133 0 O-C-N 121.998 -0.439 . . . . 0.0 110.933 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.7 t -81.73 -35.63 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.217 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.0 t -60.52 -48.85 79.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.415 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.8 ttt85 -49.39 -57.75 6.37 Favored 'General case' 0 C--O 1.227 -0.126 0 C-N-CA 124.727 1.211 . . . . 0.0 110.214 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -65.79 -13.95 60.45 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -102.19 -18.61 15.44 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.459 1.027 . . . . 0.0 109.981 175.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 34.0 mt -76.63 -34.95 58.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.0 mt-30 -67.14 -15.96 64.03 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.848 0.459 . . . . 0.0 111.719 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.2 mtp85 -87.86 -10.49 50.6 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.772 0.829 . . . . 0.0 111.094 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -141.03 34.47 1.74 Allowed 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.874 0.47 . . . . 0.0 111.374 -172.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 46.95 40.25 8.97 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.484 0.714 . . . . 0.0 112.183 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 23.4 m95 52.1 36.77 19.78 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 125.541 1.536 . . . . 0.0 113.153 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -92.15 120.25 32.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 172.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.9 tt -74.61 -18.44 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 119.058 -1.057 . . . . 0.0 111.603 -170.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -84.4 -42.12 16.0 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -69.9 -37.94 76.16 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.915 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.52 -25.78 60.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 122.612 0.365 . . . . 0.0 111.386 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.9 mt -77.32 -33.41 55.56 Favored 'General case' 0 CA--C 1.523 -0.095 0 CA-C-N 118.009 0.368 . . . . 0.0 110.292 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -72.22 -34.65 68.5 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 122.033 -0.417 . . . . 0.0 110.06 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.595 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.6 t70 -70.14 -38.0 75.39 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 178.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -69.52 -41.81 75.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 121.72 -0.612 . . . . 0.0 111.491 177.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -69.54 -11.24 60.67 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 117.891 0.314 . . . . 0.0 110.328 176.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -89.9 -7.76 53.44 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.551 0.34 . . . . 0.0 110.865 175.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.595 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -115.53 -10.9 11.84 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -171.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -66.74 -20.3 65.93 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.532 0.606 . . . . 0.0 111.652 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.2 mm -74.16 -19.52 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 122.773 0.429 . . . . 0.0 110.463 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -81.55 -3.79 90.54 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 112.186 -0.365 . . . . 0.0 112.186 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -144.65 25.64 1.46 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.69 0.757 . . . . 0.0 110.422 -178.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -78.99 -38.46 36.75 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.07 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.1 p -109.36 22.75 15.41 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.649 0.78 . . . . 0.0 110.033 176.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -106.35 2.79 26.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.742 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -103.49 13.7 32.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.991 1.316 . . . . 0.0 111.578 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 C--O 1.248 0.977 0 CA-C-O 117.134 -1.412 . . . . 0.0 110.695 -178.724 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.1 mm . . . . . 0 N--CA 1.451 -0.418 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -63.76 120.92 12.78 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 171.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -80.79 35.82 0.37 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.687 1.195 . . . . 0.0 112.311 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -146.03 25.44 1.27 Allowed 'General case' 0 N--CA 1.458 -0.072 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 -171.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -124.12 -16.76 6.4 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -173.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 53.15 60.13 3.96 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 122.249 1.023 . . . . 0.0 111.298 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.523 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -52.23 -179.23 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 126.193 1.797 . . . . 0.0 110.764 169.321 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.4 Cg_exo -66.48 -28.78 45.58 Favored 'Trans proline' 0 N--CA 1.456 -0.693 1 C-N-CA 125.632 4.221 . . . . 0.0 112.015 -173.34 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 59.2 mt-10 -95.2 -31.36 13.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.735 176.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -76.69 -12.22 59.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 123.497 0.498 . . . . 0.0 110.791 -175.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -82.52 -14.65 54.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.74 -49.25 3.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.977 169.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 mt -60.31 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.88 -176.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.493 ' HA ' HG22 ' A' ' 22' ' ' THR . 22.5 mt-10 -72.44 -20.59 61.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.049 -175.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.8 t -83.35 -30.38 27.51 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -83.3 -59.19 2.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.377 1.071 . . . . 0.0 109.75 -176.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.11 -28.79 59.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.547 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 21.8 m -83.31 -29.63 28.17 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 119.244 0.929 . . . . 0.0 112.018 175.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -81.24 -16.56 52.31 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.587 0.355 . . . . 0.0 111.108 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -120.62 -1.95 9.99 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.148 0.579 . . . . 0.0 112.016 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp 62.81 10.36 4.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.0 p -89.98 -164.02 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.72 0.808 . . . . 0.0 111.503 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -91.11 144.92 30.66 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 123.733 0.813 . . . . 0.0 110.427 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.58 -22.27 27.63 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 123.137 2.558 . . . . 0.0 113.669 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -77.95 -31.35 50.84 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.7 p -83.75 -25.43 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.139 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.3 t -61.82 -51.27 68.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 47.3 ttt85 -51.4 -58.78 5.3 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 125.386 1.475 . . . . 0.0 110.585 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -63.06 -17.84 62.7 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -176.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 11.7 m-85 -100.42 -18.11 16.88 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.373 0.988 . . . . 0.0 110.245 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.4 mt -75.25 -34.81 61.43 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 172.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 81.4 mt-30 -67.55 -14.69 63.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.858 0.463 . . . . 0.0 111.55 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -90.18 -9.65 47.39 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 124.036 0.935 . . . . 0.0 111.355 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -140.28 33.74 1.89 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.909 0.484 . . . . 0.0 111.362 -172.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.8 p80 49.01 35.54 7.02 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.347 1.059 . . . . 0.0 112.489 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.477 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 21.0 m95 56.06 38.26 29.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.681 1.593 . . . . 0.0 112.416 -178.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -88.99 120.12 30.12 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 171.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -75.14 -17.83 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 118.757 -1.177 . . . . 0.0 111.775 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.11 -41.0 16.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -176.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.7 -38.41 73.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.024 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.67 -26.54 61.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.487 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.1 mt -76.63 -35.07 58.25 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.01 0.368 . . . . 0.0 110.162 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -71.6 -36.3 70.79 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.588 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 36.0 t70 -69.4 -40.67 77.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.426 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 64.3 t80 -68.83 -41.22 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.767 -0.583 . . . . 0.0 111.274 177.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -69.53 -8.32 46.11 Favored 'General case' 0 C--O 1.231 0.096 0 CA-C-N 117.651 0.205 . . . . 0.0 110.641 175.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -93.46 -6.64 46.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.179 0.192 . . . . 0.0 110.943 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.588 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -119.58 -33.51 4.03 Favored 'General case' 0 N--CA 1.457 -0.103 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -77.76 -12.68 60.0 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.1 mm -65.09 -20.18 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 172.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -77.78 -5.01 86.2 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 123.155 0.407 . . . . 0.0 112.598 -177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.4 t -141.27 27.17 1.94 Allowed 'General case' 0 CA--C 1.528 0.116 0 CA-C-O 122.013 0.911 . . . . 0.0 110.156 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -77.57 -27.63 51.49 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.505 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 75.6 p -81.97 24.77 0.61 Allowed 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.323 0.582 . . . . 0.0 110.937 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -114.43 4.89 15.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.729 177.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -95.76 12.81 28.66 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.561 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 C--O 1.252 1.205 0 C-N-CA 124.952 1.301 . . . . 0.0 110.449 -178.747 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.6 mt . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 121.906 0.86 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.423 ' C ' ' H ' ' A' ' 9' ' ' LYS . 75.3 mmtt -106.79 50.41 0.77 Allowed 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.903 1.281 . . . . 0.0 109.999 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 -71.58 24.99 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.296 1.438 . . . . 0.0 113.263 -176.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 7' ' ' LYS . 53.5 mtmt 42.22 49.79 4.43 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.677 1.191 . . . . 0.0 111.892 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -113.98 -21.03 10.79 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.648 0.261 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 54.78 66.55 1.2 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.246 1.018 . . . . 0.0 110.554 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.506 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -52.58 179.24 0.05 OUTLIER Pre-proline 0 N--CA 1.449 -0.522 0 C-N-CA 126.701 2.0 . . . . 0.0 111.213 173.605 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.506 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.4 Cg_exo -67.43 -28.6 38.77 Favored 'Trans proline' 0 N--CA 1.455 -0.753 1 C-N-CA 125.329 4.02 . . . . 0.0 111.602 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.473 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 29.3 mt-10 -92.84 -32.31 14.67 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.381 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -76.63 -13.65 60.04 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.752 0.421 . . . . 0.0 111.186 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -82.55 -12.34 57.82 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.17 -50.12 3.04 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 170.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 28.9 mt -57.82 -48.79 82.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 CA-C-O 118.736 -0.649 . . . . 0.0 112.295 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.505 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -74.08 -20.94 60.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.111 -175.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -82.83 -31.52 28.03 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -82.63 -56.29 3.94 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.27 -175.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.505 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.44 -28.05 64.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.144 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 m -81.34 -27.96 34.7 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.992 0.815 . . . . 0.0 111.983 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.5 tp -86.66 -20.01 28.42 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.071 0.548 . . . . 0.0 111.877 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.9 p -110.05 -4.03 16.1 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 123.319 0.648 . . . . 0.0 111.302 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.1 mmtt 63.03 11.56 5.25 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.509 0.505 . . . . 0.0 111.649 169.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.0 t -93.15 -164.31 1.16 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.222 1.009 . . . . 0.0 109.926 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -96.84 145.53 29.74 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 122.92 0.488 . . . . 0.0 110.303 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 73.7 Cg_exo -54.06 -17.83 12.09 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 123.592 2.862 . . . . 0.0 114.509 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -83.66 -10.09 58.43 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.893 0.77 . . . . 0.0 111.844 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -96.94 -36.48 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.8 t -52.62 -52.17 56.68 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.463 0.649 . . . . 0.0 109.763 177.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.6 ptp180 -59.89 -36.42 76.91 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.676 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -77.19 -11.56 59.83 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 119.373 0.988 . . . . 0.0 112.724 -178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 17.3 m-85 -102.32 -20.51 14.58 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 118.967 0.803 . . . . 0.0 109.682 172.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 40.4 mt -76.23 -37.13 58.09 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 175.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 72.3 mt-30 -68.49 -12.99 62.0 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.237 0.615 . . . . 0.0 111.324 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 67.1 mtp85 -90.07 -10.55 44.34 Favored 'General case' 0 C--N 1.338 0.096 0 C-N-CA 123.695 0.798 . . . . 0.0 111.388 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -140.17 30.38 1.99 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.814 0.445 . . . . 0.0 111.593 -171.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 53.56 32.12 13.71 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 123.705 0.802 . . . . 0.0 112.584 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.473 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 18.8 m95 58.9 31.93 21.77 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.723 1.209 . . . . 0.0 112.776 -178.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -84.6 114.01 21.67 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 172.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -71.87 -16.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 C-N-CA 118.744 -1.182 . . . . 0.0 111.636 -169.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -84.85 -42.71 14.82 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -177.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -68.26 -40.39 81.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.662 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.89 63.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.567 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.85 -34.7 62.33 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-N 118.058 0.39 . . . . 0.0 110.273 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -72.29 -29.45 63.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -78.51 -17.54 56.08 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.122 0.569 . . . . 0.0 111.194 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 40.3 t80 -92.59 -37.87 12.21 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.668 1.187 . . . . 0.0 111.006 172.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -66.93 -14.42 62.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -78.82 -14.7 59.11 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 120.902 0.382 . . . . 0.0 111.19 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -100.88 -28.08 12.97 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.774 0.829 . . . . 0.0 109.908 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -79.19 -35.62 41.5 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 124.165 0.986 . . . . 0.0 110.747 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.1 mm -98.36 -25.22 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 122.927 0.491 . . . . 0.0 110.43 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.79 -5.62 30.2 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-O 119.387 -0.674 . . . . 0.0 114.169 175.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.8 t -149.23 33.39 0.73 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.285 1.042 . . . . 0.0 111.587 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -84.13 -46.41 11.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -172.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.3 t -152.66 29.04 0.54 Allowed 'General case' 0 N--CA 1.456 -0.146 0 CA-C-O 122.192 0.996 . . . . 0.0 109.885 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -67.44 -0.65 3.88 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.044 -0.98 . . . . 0.0 113.327 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -88.28 13.89 10.6 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 124.989 1.316 . . . . 0.0 112.014 178.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--O 1.25 1.089 0 C-N-CA 125.027 1.331 . . . . 0.0 110.049 -179.365 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 122.221 1.01 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.4 ' C ' ' H ' ' A' ' 9' ' ' LYS . 75.5 mmtt -105.88 51.26 0.76 Allowed 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.636 1.574 . . . . 0.0 109.355 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.84 28.86 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 125.899 1.679 . . . . 0.0 113.517 -176.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 7' ' ' LYS . 63.3 mttp 44.96 45.04 8.51 Favored 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 124.802 1.241 . . . . 0.0 111.814 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -108.2 -15.19 14.55 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 123.231 0.612 . . . . 0.0 111.314 -175.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 43.9 76.8 0.08 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.268 1.427 . . . . 0.0 111.845 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.502 ' HB3' ' HG2' ' A' ' 15' ' ' GLN . 1.3 t -38.65 163.44 0.05 OUTLIER Pre-proline 0 CA--C 1.528 0.114 0 C-N-CA 127.194 2.198 . . . . 0.0 113.643 171.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -62.31 -25.22 76.4 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.825 3.017 . . . . 0.0 109.899 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -91.54 -45.41 8.52 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 113.849 -1.523 . . . . 0.0 109.821 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.502 ' HG2' ' HB3' ' A' ' 12' ' ' SER . 9.9 mm-40 -70.22 -12.87 61.89 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.827 0.451 . . . . 0.0 111.507 -174.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -80.58 -13.24 59.23 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.717 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.11 -46.83 3.17 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 171.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 mt -58.35 -51.97 64.79 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 118.898 -0.572 . . . . 0.0 111.377 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.5 mt-10 -72.11 -22.27 61.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.131 -174.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.7 t -81.37 -33.38 32.39 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -78.65 -61.66 1.94 Allowed 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.552 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -54.15 -27.26 32.4 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 112.898 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.2 m -84.24 -28.35 27.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 118.947 0.794 . . . . 0.0 111.564 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.0 tp -83.84 -16.58 43.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.742 0.417 . . . . 0.0 111.685 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 p -118.7 -1.62 11.08 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.314 0.645 . . . . 0.0 111.607 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp 63.24 12.42 6.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 123.353 0.408 . . . . 0.0 112.036 169.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.45 -177.36 6.17 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 122.985 0.514 . . . . 0.0 111.104 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.43 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.1 t70 -80.93 146.52 59.58 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -58.31 -7.91 4.49 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.985 3.123 . . . . 0.0 114.756 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -101.64 -11.2 19.38 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-N 118.381 0.537 . . . . 0.0 111.359 177.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 50.3 t -89.78 -37.51 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 67.9 p -52.06 -51.39 57.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 122.445 1.117 . . . . 0.0 108.673 174.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 27.7 ttt85 -51.55 -53.56 36.68 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 128.133 2.573 . . . . 0.0 111.354 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -68.61 -12.43 61.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 118.677 0.671 . . . . 0.0 112.789 -177.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 27.6 m-85 -102.57 -7.93 21.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 118.727 0.694 . . . . 0.0 111.041 173.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mp -87.63 -37.99 16.3 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 172.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 80.1 mt-30 -64.69 -12.57 47.92 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -84.09 -15.46 47.28 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.36 0.664 . . . . 0.0 111.898 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -145.43 41.7 1.25 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.921 0.489 . . . . 0.0 110.969 -173.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 24.9 p80 51.29 37.76 19.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 176.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.408 ' HE1' ' HG2' ' A' ' 37' ' ' GLN . 17.0 m95 58.34 45.51 16.82 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.901 1.28 . . . . 0.0 112.066 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -96.65 113.5 25.07 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 175.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.33 -17.5 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.129 -170.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -86.3 -43.06 13.21 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -67.06 -40.04 86.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.617 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.65 72.47 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.485 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.9 mt -73.59 -31.32 63.52 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.122 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -75.75 -37.3 59.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.587 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 25.0 t70 -71.09 -40.15 71.72 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.078 -0.389 . . . . 0.0 110.612 -178.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 37.8 t80 -68.1 -40.85 82.52 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.709 -0.619 . . . . 0.0 111.555 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -71.33 -9.42 58.12 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 117.943 0.338 . . . . 0.0 110.17 176.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -91.65 -7.05 51.05 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.448 0.299 . . . . 0.0 111.14 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -116.82 -6.32 11.52 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -172.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.21 -12.82 55.34 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.277 0.489 . . . . 0.0 111.676 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.6 mm -70.86 -17.87 20.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 122.959 0.504 . . . . 0.0 109.831 178.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -79.17 -4.78 89.05 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 123.41 0.529 . . . . 0.0 112.363 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.2 t -138.83 27.54 2.43 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 121.886 0.85 . . . . 0.0 110.307 178.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.431 ' C ' ' H ' ' A' ' 60' ' ' ASP . 12.1 t80 -78.13 -25.66 47.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.79 0.836 . . . . 0.0 111.741 -175.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 68.7 p -79.82 25.04 0.37 Allowed 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.471 0.653 . . . . 0.0 111.133 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 58' ' ' PHE . 27.6 t70 -111.15 3.06 18.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.956 177.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -94.99 13.27 25.59 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.509 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 C--O 1.252 1.201 0 C-N-CA 124.774 1.23 . . . . 0.0 110.421 -178.615 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.4 mt . . . . . 0 CA--C 1.533 0.311 0 CA-C-O 121.39 0.614 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 9' ' ' LYS . 35.3 mmtp -98.59 46.11 1.0 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.946 0.898 . . . . 0.0 110.46 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -73.51 28.61 0.07 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.995 1.318 . . . . 0.0 112.249 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.438 ' H ' ' C ' ' A' ' 7' ' ' LYS . 95.7 mttt 45.82 37.56 3.6 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 125.16 1.384 . . . . 0.0 112.956 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.18 -40.88 0.17 Allowed 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.88 98.59 1.49 Allowed 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 121.958 0.885 . . . . 0.0 110.837 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.493 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -50.46 165.19 0.35 Allowed Pre-proline 0 C--N 1.332 -0.185 0 C-N-CA 125.866 1.666 . . . . 0.0 112.162 173.018 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.48 -25.37 70.36 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 123.986 3.124 . . . . 0.0 109.822 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -91.99 -45.88 8.1 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.154 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.493 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 10.0 mm-40 -69.93 -12.2 61.44 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.793 0.437 . . . . 0.0 111.666 -175.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -79.67 -14.63 58.64 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.688 177.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.54 -47.61 3.35 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.031 171.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -60.34 -50.25 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.194 -178.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -73.31 -20.7 60.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 118.381 -1.328 . . . . 0.0 111.099 -175.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.5 t -81.55 -33.29 31.81 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -80.37 -58.15 3.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.681 -176.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -58.13 -27.44 63.74 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.06 0.944 . . . . 0.0 112.488 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 m -83.04 -28.5 29.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.96 0.8 . . . . 0.0 111.347 174.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.1 tp -83.45 -14.98 51.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.7 0.4 . . . . 0.0 111.723 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.3 p -121.38 -0.66 9.79 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 123.232 0.613 . . . . 0.0 111.545 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 63.55 11.14 5.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 169.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 21.1 p -87.77 -172.27 3.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.107 0.563 . . . . 0.0 110.511 178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -89.05 145.41 34.36 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 83.1 Cg_exo -51.79 -25.31 20.57 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.322 2.681 . . . . 0.0 114.483 -178.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -79.96 -17.45 52.94 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.959 0.799 . . . . 0.0 111.536 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.5 t -84.52 -35.41 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.0 t -59.18 -52.2 66.7 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 172.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.4 ttt85 -47.56 -55.9 8.27 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.975 1.31 . . . . 0.0 110.742 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -66.04 -20.38 66.16 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -175.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -90.57 -28.16 18.65 Favored 'General case' 0 C--O 1.23 0.067 0 CA-C-N 119.466 1.03 . . . . 0.0 109.603 175.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.64 -35.5 75.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.2 mt-30 -66.76 -15.23 63.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 44.2 mtm-85 -91.4 -7.52 50.51 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 122.589 0.356 . . . . 0.0 111.066 178.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -134.02 24.43 3.91 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.239 0.616 . . . . 0.0 111.227 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 53.52 31.65 12.75 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.373 0.669 . . . . 0.0 111.914 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.6 m95 60.44 34.64 20.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.723 1.209 . . . . 0.0 112.227 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -87.57 110.51 20.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.7 tt -70.22 -16.04 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 C-N-CA 119.436 -0.906 . . . . 0.0 111.938 -171.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -85.28 -42.41 14.66 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.67 -39.71 80.46 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.66 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.85 -26.89 60.81 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.89 -177.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.2 mt -75.04 -34.67 61.89 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -69.98 -32.49 70.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -71.81 -35.29 69.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -77.29 -37.83 51.94 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.653 -0.654 . . . . 0.0 112.008 176.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -63.85 -15.13 58.12 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 118.36 0.527 . . . . 0.0 109.681 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.469 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 34.8 t70 -86.34 -14.79 42.5 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.421 0.288 . . . . 0.0 111.577 175.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -94.17 -26.11 16.82 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.939 0.496 . . . . 0.0 110.313 -176.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -68.41 -18.71 64.51 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 42.0 mm -89.26 -17.24 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 122.838 0.455 . . . . 0.0 110.581 -178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.24 20.33 71.15 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-O 119.876 -0.402 . . . . 0.0 112.942 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -112.07 21.74 15.56 Favored 'General case' 0 CA--C 1.527 0.071 0 CA-C-N 117.676 0.738 . . . . 0.0 112.276 -173.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -41.93 82.48 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.063 -172.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 33.1 p -86.84 31.74 0.69 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -121.46 4.76 10.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.838 0.828 . . . . 0.0 110.434 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -101.93 13.28 35.23 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.188 -1.369 . . . . 0.0 111.552 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.2 t . . . . . 0 C--O 1.251 1.166 0 C-N-CA 124.846 1.258 . . . . 0.0 109.677 -177.854 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -62.45 128.96 38.5 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.649 0.78 . . . . 0.0 109.054 174.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -100.32 19.64 16.25 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.365 0.666 . . . . 0.0 112.302 -177.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 45.23 34.34 1.41 Allowed 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 125.519 1.527 . . . . 0.0 113.2 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -152.82 -36.29 0.11 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 122.198 0.199 . . . . 0.0 111.137 -176.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -168.31 81.66 0.16 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 122.175 0.988 . . . . 0.0 108.468 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.516 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -59.28 -179.32 0.15 Allowed Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.06 1.744 . . . . 0.0 110.668 175.623 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.516 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 21.9 Cg_exo -67.33 -29.06 38.96 Favored 'Trans proline' 0 N--CA 1.454 -0.829 1 C-N-CA 125.703 4.268 . . . . 0.0 111.673 -174.17 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 53.7 mt-10 -94.54 -33.33 13.09 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.728 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -74.56 -13.44 60.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 122.773 0.429 . . . . 0.0 111.038 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.71 -14.79 56.1 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -50.37 3.15 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.769 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.7 mt -58.95 -49.72 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 118.734 -0.65 . . . . 0.0 112.236 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.503 ' HA ' HG22 ' A' ' 22' ' ' THR . 19.7 mt-10 -73.56 -21.12 60.45 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.054 -175.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.74 -33.34 31.1 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -80.82 -58.43 3.1 Favored 'General case' 0 N--CA 1.438 -1.041 0 C-N-CA 124.462 1.105 . . . . 0.0 109.643 -175.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.503 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -58.23 -27.72 64.21 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.635 -179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.7 m -82.1 -28.22 32.42 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 118.888 0.767 . . . . 0.0 111.464 173.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 48.0 tp -83.12 -15.68 49.77 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 111.79 177.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.1 p -118.85 -1.54 11.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 122.927 0.491 . . . . 0.0 111.59 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 63.23 11.21 5.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.717 0.407 . . . . 0.0 111.891 169.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -92.98 -173.02 3.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.877 0.871 . . . . 0.0 110.205 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -84.79 143.67 40.96 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 122.939 0.496 . . . . 0.0 110.503 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -55.53 -26.75 56.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.452 2.768 . . . . 0.0 113.896 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-N 118.149 0.431 . . . . 0.0 110.989 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -87.78 -36.94 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.16 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 27.8 t -58.08 -48.67 79.44 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 45.6 ttt85 -47.99 -55.62 9.61 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.322 1.449 . . . . 0.0 110.642 176.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -70.27 -13.41 62.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -97.67 -26.12 14.87 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 119.267 0.94 . . . . 0.0 109.269 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 36.6 mt -72.42 -33.14 66.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 83.1 mt-30 -68.58 -14.34 62.95 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 122.053 -0.404 . . . . 0.0 111.707 -179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -92.87 -7.59 45.81 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 123.149 0.579 . . . . 0.0 111.127 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -134.29 25.56 3.83 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.418 0.687 . . . . 0.0 111.743 -175.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 53.71 30.53 11.24 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.597 0.759 . . . . 0.0 112.279 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 15.9 m95 59.53 33.77 22.25 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.918 1.287 . . . . 0.0 112.643 -178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -85.22 116.18 23.43 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.55 -2.018 . . . . 0.0 105.55 172.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -74.18 -16.4 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 118.94 -1.104 . . . . 0.0 111.689 -170.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -84.88 -40.74 16.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -70.65 -40.34 73.1 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.964 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.49 62.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -177.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.1 mt -75.74 -36.16 60.0 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.086 0.403 . . . . 0.0 110.116 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -70.07 -31.01 68.4 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 177.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -70.44 -35.92 73.66 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -76.58 -37.7 56.1 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 121.763 -0.586 . . . . 0.0 111.964 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -63.68 -15.44 58.39 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.46 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 36.0 t70 -86.65 -15.43 39.67 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 176.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.604 ' HE3' ' N ' ' A' ' 53' ' ' LYS . 0.0 OUTLIER -92.47 -24.71 18.72 Favored 'General case' 0 CA--C 1.522 -0.118 0 C-N-CA 123.022 0.529 . . . . 0.0 110.327 -176.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -67.29 -12.34 59.89 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.508 0.323 . . . . 0.0 111.835 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 47.4 mm -83.71 -11.83 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 123.45 0.7 . . . . 0.0 110.375 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -68.81 2.75 7.53 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.031 0.824 . . . . 0.0 113.893 -176.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -98.76 23.02 9.26 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 117.813 0.807 . . . . 0.0 111.743 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -69.94 -23.94 63.28 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.28 0.632 . . . . 0.0 112.421 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 77.9 p -75.36 29.11 0.1 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -174.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -115.18 2.57 14.13 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 123.968 0.907 . . . . 0.0 110.807 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -100.9 12.2 38.09 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 114.314 -1.312 . . . . 0.0 111.373 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.789 1.636 . . . . 0.0 111.017 -177.919 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 62.8 mt . . . . . 0 C--O 1.232 0.172 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 6.3 mmpt? -75.56 131.6 40.14 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.7 mmt-85 -80.44 28.16 0.33 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.318 1.047 . . . . 0.0 112.315 -177.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -145.76 12.07 1.28 Allowed 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.249 1.02 . . . . 0.0 110.833 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -156.41 -30.27 0.09 Allowed 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.067 0.547 . . . . 0.0 111.634 -177.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 53.63 -128.08 2.36 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 122.656 1.217 . . . . 0.0 109.018 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.528 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -166.22 165.66 10.14 Favored Pre-proline 0 C--N 1.314 -0.952 0 CA-C-N 112.416 -2.174 . . . . 0.0 110.292 -174.856 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -67.26 -25.5 42.74 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 123.858 3.039 . . . . 0.0 109.818 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 33.1 mt-10 -91.67 -47.15 7.54 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.252 177.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 13.8 mm-40 -70.56 -11.24 60.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 123.266 0.354 . . . . 0.0 111.628 -174.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.35 -14.3 58.46 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.49 -51.52 2.86 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.664 0.603 . . . . 0.0 109.922 172.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.7 mt -55.65 -48.44 77.71 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.509 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.919 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.515 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.08 -22.5 59.49 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 118.718 -1.193 . . . . 0.0 110.893 -175.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -81.49 -29.71 33.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -84.11 -53.7 5.34 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.515 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -57.38 -29.19 63.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.854 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 m -81.52 -26.76 34.85 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 118.725 0.693 . . . . 0.0 112.157 176.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 56.9 tp -90.2 -22.4 21.7 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.397 0.679 . . . . 0.0 112.297 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.7 p -109.06 -4.5 16.57 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 123.007 0.523 . . . . 0.0 111.268 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.3 mmtt 63.64 11.85 6.08 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 123.455 0.472 . . . . 0.0 111.778 168.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.6 t -97.97 -165.53 1.26 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.628 1.171 . . . . 0.0 110.056 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -84.88 152.23 59.0 Favored Pre-proline 0 CA--C 1.532 0.281 0 C-N-CA 123.232 0.613 . . . . 0.0 110.67 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -69.79 -22.66 31.64 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.403 2.735 . . . . 0.0 111.701 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -78.66 -16.21 57.59 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 117.862 0.301 . . . . 0.0 110.694 176.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.75 -32.4 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.225 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 175.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 52.0 m -60.51 -41.31 94.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 172.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 38.2 ttt-85 -66.61 -23.05 66.13 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 125.26 1.424 . . . . 0.0 112.608 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -99.39 -4.95 30.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 120.148 1.34 . . . . 0.0 111.642 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 29.3 m-85 -107.23 -7.89 16.61 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 33.1 mt -88.57 -38.27 15.03 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 171.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 43.3 mt-30 -67.31 -6.75 20.02 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.2 mtp85 -86.57 -14.46 42.81 Favored 'General case' 0 N--CA 1.457 -0.075 0 C-N-CA 122.539 0.335 . . . . 0.0 111.702 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -146.88 37.56 0.97 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.962 0.505 . . . . 0.0 111.709 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 58.08 34.42 24.19 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.485 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.9 m95 58.55 38.33 25.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.427 1.091 . . . . 0.0 112.524 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -88.06 111.77 21.91 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 175.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.1 tt -70.19 -15.15 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 C-N-CA 118.944 -1.102 . . . . 0.0 112.265 -169.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.06 -41.39 14.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -178.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.8 m-30 -68.59 -42.61 77.97 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.47 178.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.59 -34.46 77.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.854 0.862 . . . . 0.0 111.623 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.0 mt -73.24 -33.55 65.37 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.316 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -74.4 -34.12 63.2 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 118.061 0.391 . . . . 0.0 110.213 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.602 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 21.6 t70 -72.48 -41.16 66.32 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.459 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 53.8 t80 -65.4 -38.59 90.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.702 -0.624 . . . . 0.0 111.325 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -74.42 -10.84 59.97 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.168 -0.332 . . . . 0.0 110.421 174.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -88.0 -14.96 37.72 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 117.652 0.206 . . . . 0.0 110.966 176.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -105.36 -22.29 13.06 Favored 'General case' 0 CA--C 1.523 -0.062 0 C-N-CA 123.688 0.795 . . . . 0.0 111.312 -178.573 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.452 ' C ' ' H ' ' A' ' 56' ' ' GLY . 29.1 mm-40 -104.98 -33.84 8.2 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.525 0.73 . . . . 0.0 110.868 -175.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.6 mt 58.41 0.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 C-N-CA 125.805 1.642 . . . . 0.0 113.16 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.452 ' H ' ' C ' ' A' ' 54' ' ' GLU . . . -63.02 3.02 1.13 Allowed Glycine 0 CA--C 1.53 0.983 0 C-N-CA 125.797 1.665 . . . . 0.0 114.007 -177.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.0 t -105.37 23.54 13.57 Favored 'General case' 0 N--CA 1.461 0.089 0 CA-C-N 118.141 0.971 . . . . 0.0 111.078 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -67.2 -23.48 65.75 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 74.9 p -74.44 30.65 0.08 Allowed 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -174.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.6 4.95 14.24 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 122.105 0.955 . . . . 0.0 111.125 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -91.51 13.05 18.82 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.509 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.253 1.239 0 C-N-CA 125.249 1.42 . . . . 0.0 110.374 -178.677 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 49.4 mt . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -76.26 3.84 10.0 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 125.335 1.454 . . . . 0.0 112.875 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? 26.73 33.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 130.621 3.568 . . . . 0.0 114.245 -173.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.2 mttt 44.33 37.3 1.92 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.288 1.035 . . . . 0.0 111.893 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -152.02 -27.21 0.18 Allowed 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 111.979 0.362 . . . . 0.0 111.979 -171.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -163.25 81.5 0.47 Allowed 'General case' 0 N--CA 1.438 -1.035 0 CA-C-O 122.396 1.093 . . . . 0.0 109.131 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.512 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -59.43 -178.95 0.14 Allowed Pre-proline 0 N--CA 1.447 -0.584 0 CA-C-N 113.154 -1.839 . . . . 0.0 110.382 173.671 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.512 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.0 Cg_exo -67.01 -28.57 41.52 Favored 'Trans proline' 0 N--CA 1.454 -0.823 1 C-N-CA 125.331 4.021 . . . . 0.0 112.06 -174.215 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 68.0 mt-10 -95.37 -34.83 11.99 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.168 -0.924 . . . . 0.0 109.647 177.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -72.58 -13.31 61.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 123.498 0.499 . . . . 0.0 111.247 -176.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -82.05 -14.91 55.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.41 -48.98 3.44 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 169.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.1 mt -60.46 -50.94 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.056 -175.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.4 mt-10 -72.11 -20.93 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.672 -1.211 . . . . 0.0 111.115 -174.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -84.19 -28.27 27.46 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 122.026 0.917 . . . . 0.0 108.65 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -85.62 -58.34 2.7 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 114.773 -1.103 . . . . 0.0 109.174 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -57.06 -26.14 59.86 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.093 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.4 p -79.1 -38.97 34.88 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 118.934 0.788 . . . . 0.0 111.627 172.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 45.7 tp -77.28 -12.71 59.98 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.04 0.536 . . . . 0.0 112.094 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.8 p -123.22 -0.59 8.82 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.257 0.623 . . . . 0.0 111.747 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp 62.98 10.91 4.72 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 169.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.4 p -88.17 -171.82 3.54 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 123.181 0.593 . . . . 0.0 111.084 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -87.32 146.0 38.96 Favored Pre-proline 0 CA--C 1.533 0.308 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -55.9 -23.08 40.88 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.365 2.71 . . . . 0.0 113.691 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -84.72 -11.36 55.99 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.969 0.349 . . . . 0.0 111.255 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -87.87 -38.38 11.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.8 t -57.52 -45.38 85.07 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.9 ttt85 -49.31 -58.48 5.01 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.98 1.312 . . . . 0.0 110.353 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -66.25 -14.38 61.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -174.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.41 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 24.4 m-85 -100.56 -17.77 16.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.229 0.922 . . . . 0.0 110.028 175.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 31.3 mt -78.58 -35.8 45.32 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 78.8 mt-30 -65.56 -15.43 62.69 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.731 0.412 . . . . 0.0 111.645 177.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -87.15 -10.41 52.78 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 123.674 0.789 . . . . 0.0 111.218 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -140.98 33.62 1.75 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 122.734 0.414 . . . . 0.0 111.398 -172.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 p80 49.19 35.09 6.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.153 0.981 . . . . 0.0 112.534 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 20.6 m95 57.32 38.68 28.64 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.245 1.418 . . . . 0.0 112.724 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.57 119.3 31.37 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.044 -1.835 . . . . 0.0 106.044 172.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -74.44 -18.28 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 119.024 -1.07 . . . . 0.0 111.734 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -84.87 -42.2 15.28 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -176.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.6 m-30 -68.88 -38.86 79.94 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.803 177.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.03 -26.67 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.428 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -76.35 -33.44 58.96 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 118.025 0.375 . . . . 0.0 110.341 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -72.72 -34.12 66.89 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 118.147 0.43 . . . . 0.0 109.953 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.601 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 28.4 t70 -70.82 -40.23 72.58 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.07 -0.394 . . . . 0.0 110.241 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.41 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.1 t80 -66.24 -39.43 89.54 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.689 -0.632 . . . . 0.0 111.245 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -75.81 -6.52 51.1 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 122.219 -0.3 . . . . 0.0 110.674 174.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -90.4 -15.93 30.05 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.609 0.242 . . . . 0.0 110.878 175.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -99.3 -28.0 13.51 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.373 0.669 . . . . 0.0 110.871 -178.221 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -137.97 100.41 4.15 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 122.227 1.013 . . . . 0.0 108.628 173.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.7 mm -63.1 -20.31 25.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 113.987 -1.46 . . . . 0.0 111.281 -178.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.11 -4.04 73.45 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 123.349 0.5 . . . . 0.0 113.053 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -140.58 27.24 2.07 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 117.793 0.796 . . . . 0.0 110.503 177.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -145.84 -37.72 0.25 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.306 1.043 . . . . 0.0 109.534 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.4 p -89.41 25.35 1.97 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.81 0.844 . . . . 0.0 110.17 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -87.19 -1.24 57.75 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.073 -177.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.06 22.38 13.01 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 124.527 1.131 . . . . 0.0 112.757 -178.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.862 -1.066 . . . . 0.0 110.602 178.874 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 121.198 0.523 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HE3' ' CA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -75.04 150.04 39.03 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.016 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -133.28 73.65 1.53 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 124.428 1.091 . . . . 0.0 109.536 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -76.47 44.96 0.37 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.75 -177.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -121.32 -10.87 8.86 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.95 0.9 . . . . 0.0 111.736 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 55.97 62.7 2.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 122.497 1.141 . . . . 0.0 110.87 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.536 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -52.67 -178.92 0.04 OUTLIER Pre-proline 0 N--CA 1.448 -0.536 0 C-N-CA 126.586 1.954 . . . . 0.0 110.951 169.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.536 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.5 Cg_exo -67.62 -29.87 35.8 Favored 'Trans proline' 0 N--CA 1.453 -0.853 1 C-N-CA 125.519 4.146 . . . . 0.0 111.778 -173.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 31.5 mt-10 -91.96 -32.93 15.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.356 176.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -76.71 -11.8 59.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.018 0.527 . . . . 0.0 111.16 -174.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.47 -13.18 52.75 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.96 -45.39 3.63 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 170.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.2 mt -61.17 -50.33 80.93 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.547 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.487 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.0 mt-10 -72.63 -20.74 61.22 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 118.745 -1.182 . . . . 0.0 110.967 -174.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -83.05 -32.99 26.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -80.09 -59.06 2.86 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.247 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.487 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -56.92 -27.35 60.83 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.212 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.1 m -82.29 -27.09 32.55 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.076 0.853 . . . . 0.0 112.076 174.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 59.7 tp -88.47 -21.03 24.41 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.198 0.599 . . . . 0.0 111.923 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -110.34 -3.2 16.3 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 123.168 0.587 . . . . 0.0 110.89 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt 63.58 12.94 6.87 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 123.647 0.592 . . . . 0.0 111.72 168.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.8 p -88.89 -165.59 1.38 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.911 0.884 . . . . 0.0 110.427 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 13.8 t70 -97.05 146.62 31.62 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 85.3 Cg_exo -53.29 -18.61 10.94 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.444 2.763 . . . . 0.0 114.257 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -82.77 -13.77 55.68 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.8 0.727 . . . . 0.0 111.846 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -92.05 -36.36 7.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.0 t -54.18 -56.58 16.83 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 18.9 ptp180 -57.45 -39.28 75.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.803 -174.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -73.74 -14.33 61.11 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.034 0.834 . . . . 0.0 112.787 -178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.405 ' CD2' ' NH2' ' A' ' 38' ' ' ARG . 11.0 m-85 -98.44 -26.11 14.57 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 118.762 0.71 . . . . 0.0 109.857 172.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.28 -33.93 61.29 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 70.5 mt-30 -67.35 -12.13 59.42 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.166 0.586 . . . . 0.0 111.511 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.405 ' NH2' ' CD2' ' A' ' 35' ' ' TYR . 33.2 mtm-85 -97.79 -10.39 24.89 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 122.873 0.469 . . . . 0.0 111.463 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -131.03 27.88 4.83 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.368 0.667 . . . . 0.0 110.872 -174.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 53.59 31.7 13.0 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.702 0.801 . . . . 0.0 112.125 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.472 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 16.9 m95 58.77 31.53 21.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.347 1.059 . . . . 0.0 112.378 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.53 110.69 18.87 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.3 tt -70.42 -15.7 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 C-N-CA 119.378 -0.929 . . . . 0.0 111.867 -170.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -85.07 -42.29 14.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.74 -39.91 80.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.646 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.8 -26.03 60.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.757 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.5 mt -73.9 -34.84 64.55 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -72.98 -27.21 61.67 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 176.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -82.63 -12.18 57.85 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.746 0.419 . . . . 0.0 111.761 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -98.46 -36.15 10.03 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.76 1.224 . . . . 0.0 110.926 172.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -71.57 -10.09 59.23 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 172.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -76.51 -15.97 59.76 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 120.922 0.391 . . . . 0.0 110.434 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -102.88 -33.85 9.19 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.764 0.826 . . . . 0.0 110.156 -178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -76.49 -36.12 58.01 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.996 0.918 . . . . 0.0 111.327 -177.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 49.3 mm -86.31 -14.19 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 122.756 0.422 . . . . 0.0 110.009 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.87 -6.44 78.38 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 123.707 0.67 . . . . 0.0 112.537 -177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.9 t -139.5 27.28 2.29 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.415 0.686 . . . . 0.0 110.286 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.423 ' C ' ' H ' ' A' ' 60' ' ' ASP . 13.5 t80 -75.95 -25.52 56.0 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.336 -174.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.2 p -79.51 24.01 0.38 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 123.226 0.61 . . . . 0.0 111.241 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.423 ' H ' ' C ' ' A' ' 58' ' ' PHE . 28.4 t70 -111.7 3.8 18.08 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.846 177.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -93.96 13.75 21.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.334 -1.303 . . . . 0.0 111.375 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.252 1.22 0 CA-C-O 117.147 -1.406 . . . . 0.0 109.766 -178.613 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -63.68 128.79 37.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.149 174.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -97.26 54.84 1.24 Allowed 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.294 1.038 . . . . 0.0 110.391 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -124.39 20.04 8.84 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.149 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -153.94 -30.75 0.12 Allowed 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 123.672 0.789 . . . . 0.0 110.941 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -155.45 102.87 2.28 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.885 0.85 . . . . 0.0 109.273 174.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -56.03 164.23 1.88 Allowed Pre-proline 0 C--N 1.328 -0.337 0 C-N-CA 125.244 1.418 . . . . 0.0 111.797 176.082 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -64.4 -25.58 63.56 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 124.215 3.277 . . . . 0.0 110.063 179.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -90.52 -45.34 9.0 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 113.388 -1.733 . . . . 0.0 109.914 177.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.75 -15.63 62.7 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.007 0.523 . . . . 0.0 110.894 -173.138 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.62 -13.53 60.06 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.95 -56.74 2.33 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.077 170.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 mt -51.91 -51.21 30.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 C-N-CA 123.395 0.678 . . . . 0.0 112.411 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.2 mt-10 -75.55 -20.32 58.74 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 118.153 -1.419 . . . . 0.0 111.127 -173.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.6 t -80.89 -32.35 34.84 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -80.96 -59.22 2.75 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.6 1.16 . . . . 0.0 109.307 -174.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -56.48 -28.61 60.21 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.505 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.2 m -81.93 -26.09 34.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 118.836 0.744 . . . . 0.0 111.776 175.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.75 -23.3 25.52 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.13 0.572 . . . . 0.0 111.87 178.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.9 p -107.6 -3.98 18.76 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.066 0.546 . . . . 0.0 110.791 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt 63.67 12.27 6.44 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 122.658 0.383 . . . . 0.0 111.473 169.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.8 t -94.44 -167.89 1.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.401 1.08 . . . . 0.0 110.792 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -88.17 142.09 31.53 Favored Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.034 0.934 . . . . 0.0 109.423 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -64.98 -17.05 58.34 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.276 2.651 . . . . 0.0 113.187 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 11.2 mmpt? -83.22 -9.92 58.87 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 118.394 0.543 . . . . 0.0 110.329 176.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 56.4 t -91.86 -35.2 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -57.49 -46.54 83.6 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 76.4 ttt-85 -47.52 -58.45 4.2 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 125.316 1.446 . . . . 0.0 110.052 175.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -68.78 -11.74 60.71 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -175.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 19.5 m-85 -102.77 -17.01 15.78 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.398 0.999 . . . . 0.0 109.714 174.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.9 mt -80.07 -35.69 36.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 80.6 mt-30 -65.96 -17.09 64.44 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.761 0.425 . . . . 0.0 111.389 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.3 mtp85 -83.45 -9.52 58.95 Favored 'General case' 0 C--O 1.23 0.042 0 C-N-CA 123.502 0.721 . . . . 0.0 111.062 177.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -142.01 27.7 1.78 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 54.41 31.34 14.4 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.36 0.664 . . . . 0.0 112.402 179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 14.9 m95 60.16 34.5 21.13 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.795 1.238 . . . . 0.0 112.621 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -86.98 116.91 25.35 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 172.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.8 tt -73.29 -17.6 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 C-N-CA 118.913 -1.115 . . . . 0.0 111.677 -169.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.59 -42.32 15.54 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.84 -39.57 79.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.595 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.4 -27.06 62.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.607 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 28.8 mt -76.08 -33.88 59.53 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.259 0.481 . . . . 0.0 110.508 177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -71.66 -35.34 70.31 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.602 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 28.2 t70 -70.97 -41.38 71.12 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 59.7 t80 -65.24 -39.1 92.26 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 121.635 -0.666 . . . . 0.0 111.182 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -77.14 -4.95 47.13 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 122.389 -0.195 . . . . 0.0 110.782 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -91.21 -17.54 25.87 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.708 0.231 . . . . 0.0 111.001 174.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.602 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -97.4 -27.06 14.64 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.307 0.643 . . . . 0.0 110.955 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -139.3 101.36 4.23 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 172.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mm -61.45 -18.41 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 113.974 -1.466 . . . . 0.0 111.253 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.42 7.98 87.64 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-O 119.657 -0.524 . . . . 0.0 112.991 177.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.2 t -133.82 20.82 3.85 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 117.901 0.851 . . . . 0.0 111.852 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -76.48 -29.97 57.09 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.28 0.562 . . . . 0.0 111.393 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 9.7 t -91.29 30.74 1.22 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.198 -174.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.2 t70 47.73 37.38 6.89 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 122.889 1.328 . . . . 0.0 112.09 -175.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 45.97 28.21 0.59 Allowed 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.675 2.39 . . . . 0.0 114.896 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.953 -1.022 . . . . 0.0 111.167 179.898 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 59.3 mt . . . . . 0 C--O 1.232 0.174 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.403 ' HE3' ' CA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -80.37 142.53 34.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 169.687 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -97.2 20.07 12.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.914 0.886 . . . . 0.0 112.426 -177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.5 mttt 47.66 23.72 0.45 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.244 1.818 . . . . 0.0 114.7 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -155.6 -59.55 0.1 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.057 0.39 . . . . 0.0 111.524 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -166.35 74.09 0.17 Allowed 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 122.393 1.092 . . . . 0.0 109.478 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.539 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -60.25 -177.71 0.13 Allowed Pre-proline 0 N--CA 1.445 -0.682 0 CA-C-N 113.247 -1.797 . . . . 0.0 110.106 172.438 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.539 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 23.5 Cg_exo -67.88 -30.46 33.19 Favored 'Trans proline' 0 N--CA 1.455 -0.785 1 C-N-CA 125.51 4.14 . . . . 0.0 111.166 -175.159 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.1 mt-10 -88.66 -38.54 14.71 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.477 177.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 -8.22 57.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -171.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -84.52 -12.87 53.38 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.88 -49.82 2.85 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.304 170.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.07 -52.47 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 CA-C-N 118.648 0.658 . . . . 0.0 112.282 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.563 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.4 mt-10 -74.55 -20.62 59.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 118.387 -1.325 . . . . 0.0 110.803 -172.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.1 t -80.89 -33.46 34.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -78.25 -63.42 1.4 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.485 -177.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.4 t -52.67 -27.65 18.25 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.304 1.041 . . . . 0.0 112.917 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.3 m -84.2 -28.05 27.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.277 0.944 . . . . 0.0 112.039 174.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.82 -18.97 35.82 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.028 0.531 . . . . 0.0 111.473 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.2 p -116.83 -1.87 11.95 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.36 12.33 6.18 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 123.542 0.526 . . . . 0.0 112.357 169.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.0 p -86.03 -175.37 5.53 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.956 0.503 . . . . 0.0 110.886 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.446 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 15.3 t70 -83.55 145.82 48.72 Favored Pre-proline 0 CA--C 1.534 0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 53.4 Cg_exo -57.81 -9.29 5.52 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.796 2.997 . . . . 0.0 114.749 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -99.25 -12.71 20.14 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.597 0.635 . . . . 0.0 111.473 177.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -89.47 -38.13 10.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.7 p -54.36 -49.5 69.67 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.083 0.944 . . . . 0.0 108.601 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 20.3 ttt85 -53.74 -52.36 60.39 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.982 2.513 . . . . 0.0 111.618 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -67.76 -18.01 64.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.694 0.679 . . . . 0.0 112.456 -177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.439 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 22.4 m-85 -95.05 -20.41 19.35 Favored 'General case' 0 C--N 1.338 0.081 0 CA-C-N 119.041 0.837 . . . . 0.0 110.25 174.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.5 mp -75.36 -39.15 59.59 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 82.1 mt-30 -64.45 -18.72 65.02 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.169 0.588 . . . . 0.0 111.717 178.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 59.5 mtp85 -81.12 -9.44 59.81 Favored 'General case' 0 C--N 1.339 0.124 0 C-N-CA 123.373 0.669 . . . . 0.0 111.174 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -140.52 27.55 2.06 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.634 0.374 . . . . 0.0 111.839 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 53.9 33.39 17.12 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.549 0.74 . . . . 0.0 112.116 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 15.7 m95 59.87 31.6 20.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.519 1.128 . . . . 0.0 112.67 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -86.6 112.08 21.25 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.4 tt -69.75 -16.97 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 C-N-CA 119.563 -0.855 . . . . 0.0 111.912 -170.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -85.26 -42.75 14.36 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -177.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -68.55 -38.88 81.18 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.6 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.66 -26.94 61.82 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.6 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -74.22 -34.31 63.65 Favored 'General case' 0 C--N 1.338 0.078 0 CA-C-N 118.222 0.465 . . . . 0.0 109.935 177.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -71.48 -35.79 70.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.154 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.586 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 30.4 t70 -70.93 -42.09 70.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.418 -0.216 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 39.3 t80 -66.38 -38.65 88.04 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.574 -0.704 . . . . 0.0 111.424 177.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -76.78 -5.68 49.16 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 117.555 0.161 . . . . 0.0 110.818 174.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -90.51 -16.72 28.34 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 117.925 0.33 . . . . 0.0 111.215 175.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -98.0 -21.78 16.63 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 123.793 0.837 . . . . 0.0 111.322 -177.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -146.57 81.6 1.57 Allowed 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 124.377 1.071 . . . . 0.0 108.937 176.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.0 mt -70.04 -23.24 25.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.806 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.22 -1.68 79.7 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.463 0.554 . . . . 0.0 112.963 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.6 t -139.57 23.63 2.48 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 122.156 0.979 . . . . 0.0 110.719 178.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -144.92 -39.38 0.26 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.992 -1.004 . . . . 0.0 108.871 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p -86.48 24.11 1.48 Allowed 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.52 0.728 . . . . 0.0 110.374 172.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -115.91 6.78 14.3 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 124.474 1.11 . . . . 0.0 110.639 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -93.61 12.96 23.54 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.648 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 18.9 m . . . . . 0 C--O 1.252 1.189 0 C-N-CA 125.457 1.503 . . . . 0.0 110.96 -178.151 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mt . . . . . 0 N--CA 1.457 -0.116 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -68.79 104.2 1.97 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.113 0.965 . . . . 0.0 110.029 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' H ' ' HD3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -75.44 21.48 0.14 Allowed 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -178.018 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -146.62 14.04 1.21 Allowed 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.426 1.09 . . . . 0.0 111.271 -174.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -156.42 -33.25 0.09 Allowed 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 122.965 0.506 . . . . 0.0 111.251 -176.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -157.69 97.29 1.57 Allowed 'General case' 0 N--CA 1.444 -0.77 0 CA-C-O 121.849 0.833 . . . . 0.0 110.375 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.598 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER -52.1 163.94 0.64 Allowed Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 125.233 1.413 . . . . 0.0 112.057 176.115 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -63.52 -25.45 70.06 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.958 3.105 . . . . 0.0 110.009 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -90.73 -45.92 8.56 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 113.625 -1.625 . . . . 0.0 109.885 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.598 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.73 -16.19 62.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.171 0.588 . . . . 0.0 110.88 -172.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.42 -14.0 60.09 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.81 -54.55 2.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 123.644 0.59 . . . . 0.0 110.176 171.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 mt -52.78 -53.3 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 CA-C-O 118.737 -0.649 . . . . 0.0 112.267 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.556 ' HA ' HG22 ' A' ' 22' ' ' THR . 17.3 mt-10 -73.18 -21.26 60.72 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 118.088 -1.445 . . . . 0.0 111.072 -173.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.0 t -81.46 -29.6 33.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -85.34 -56.96 3.27 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 124.153 0.981 . . . . 0.0 109.542 -174.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.556 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.6 t -57.06 -27.43 61.69 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.071 -0.968 . . . . 0.0 112.293 178.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -83.6 -30.33 27.05 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 119.076 0.853 . . . . 0.0 111.533 174.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.7 tp -81.4 -16.09 53.21 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.855 0.462 . . . . 0.0 111.325 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.9 p -120.11 -1.28 10.37 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.558 0.743 . . . . 0.0 111.705 -177.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp 63.05 10.07 4.23 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 123.455 0.472 . . . . 0.0 112.242 169.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.5 p -89.33 -172.44 3.62 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.183 0.593 . . . . 0.0 110.925 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -86.94 145.19 37.96 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -55.22 -23.16 35.63 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 123.387 2.725 . . . . 0.0 113.864 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -83.97 -12.5 55.22 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.026 0.375 . . . . 0.0 111.127 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.7 t -86.48 -38.65 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.5 t -57.71 -47.1 83.32 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.479 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 74.1 ttt-85 -53.52 -23.88 11.76 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 125.072 1.349 . . . . 0.0 112.263 177.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -99.94 -11.04 21.0 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 120.419 1.463 . . . . 0.0 112.315 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.432 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 40.3 m-85 -102.0 -7.36 22.43 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.082 0.401 . . . . 0.0 109.974 171.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.435 HD23 ' CE3' ' A' ' 41' ' ' TRP . 4.7 mp -86.9 -41.98 13.56 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 77.0 mt-30 -64.74 -10.43 27.45 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -76.81 -21.85 54.49 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 123.719 0.808 . . . . 0.0 111.372 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -144.45 35.73 1.19 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.137 0.575 . . . . 0.0 112.399 -171.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 57.55 36.16 26.56 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CE3' HD23 ' A' ' 36' ' ' LEU . 17.0 m95 60.13 46.0 11.09 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.009 0.923 . . . . 0.0 112.602 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -98.68 111.05 23.55 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 175.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.6 tt -67.06 -17.83 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 C-N-CA 120.237 -0.585 . . . . 0.0 112.15 -171.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -86.68 -44.02 12.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 O-C-N 121.347 -0.845 . . . . 0.0 108.896 -176.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.4 m-30 -66.45 -38.54 87.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.537 177.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.37 -30.74 68.8 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.265 0.626 . . . . 0.0 112.004 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 29.7 mt -72.73 -31.54 65.04 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.777 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -74.6 -36.77 62.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.597 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 35.3 t70 -69.16 -44.37 72.4 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 117.803 0.274 . . . . 0.0 110.609 -179.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.432 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 30.3 t80 -68.85 -36.63 78.37 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.694 -0.629 . . . . 0.0 111.506 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -74.88 -7.92 54.94 Favored 'General case' 0 CA--C 1.529 0.151 0 O-C-N 122.061 -0.399 . . . . 0.0 110.282 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -92.39 -11.42 34.94 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.084 0.154 . . . . 0.0 111.15 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.597 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -113.23 -41.31 3.72 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.103 0.561 . . . . 0.0 112.06 -176.152 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -101.14 -38.39 8.15 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.186 0.594 . . . . 0.0 111.59 -173.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.6 -14.28 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 C-N-CA 122.805 0.442 . . . . 0.0 110.102 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.457 ' HA2' ' CZ ' ' A' ' 58' ' ' PHE . . . -72.04 9.76 5.03 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 124.217 0.913 . . . . 0.0 113.028 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.6 t -93.39 22.65 5.08 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.82 0.848 . . . . 0.0 112.392 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.457 ' CZ ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -56.86 -37.41 71.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.145 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.2 p -81.21 34.71 0.37 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.718 0.807 . . . . 0.0 112.878 -177.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -117.49 4.15 12.45 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.877 0.846 . . . . 0.0 110.884 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -95.21 12.83 27.49 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.274 -1.33 . . . . 0.0 111.454 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 C--O 1.249 1.057 0 CA-C-O 116.966 -1.492 . . . . 0.0 111.295 -178.067 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.0 mp . . . . . 0 CA--C 1.531 0.212 0 CA-C-O 121.276 0.56 . . . . 0.0 109.746 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.616 ' HA ' ' HE2' ' A' ' 7' ' ' LYS . 8.4 mmpt? -70.55 137.66 50.29 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -105.0 25.74 10.13 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 -169.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.3 mttt 50.93 50.15 19.67 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.005 0.922 . . . . 0.0 111.135 -176.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -145.01 -30.79 0.43 Allowed 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 123.955 0.902 . . . . 0.0 111.132 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.93 101.18 1.93 Allowed 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.593 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -51.35 164.15 0.51 Allowed Pre-proline 0 CA--C 1.533 0.291 0 C-N-CA 125.229 1.412 . . . . 0.0 112.055 176.744 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -63.76 -26.53 68.07 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 124.003 3.135 . . . . 0.0 109.917 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.424 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 52.4 mt-10 -89.07 -47.51 8.05 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.169 -1.832 . . . . 0.0 109.892 177.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.593 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.25 -16.27 63.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.753 0.658 . . . . 0.0 111.157 -172.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -76.9 -12.34 59.94 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -113.95 -51.64 2.77 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.617 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 mt -54.84 -53.15 35.84 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.517 0 CA-C-O 118.713 -0.661 . . . . 0.0 111.628 -178.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.572 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.5 mt-10 -73.93 -20.78 60.28 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.203 -172.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -82.3 -28.62 31.6 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -84.15 -63.81 1.28 Allowed 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.925 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.572 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.3 t -49.63 -28.23 5.58 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.341 1.057 . . . . 0.0 112.733 177.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.3 p -79.51 -39.55 31.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.27 0.941 . . . . 0.0 111.803 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 53.0 tp -78.19 -18.74 55.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.471 0.709 . . . . 0.0 111.983 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 44.0 p -111.13 -3.04 15.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.273 0.629 . . . . 0.0 110.801 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 63.82 11.59 6.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 123.543 0.527 . . . . 0.0 111.935 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.9 p -94.49 -174.44 3.33 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.941 0.497 . . . . 0.0 111.606 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -80.94 151.41 70.48 Favored Pre-proline 0 N--CA 1.454 -0.271 0 C-N-CA 123.098 0.559 . . . . 0.0 111.055 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.88 -2.18 9.82 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.983 3.122 . . . . 0.0 112.217 -177.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -102.37 -7.8 21.72 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.2 0.6 . . . . 0.0 111.07 175.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 35.3 t -102.54 -35.28 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.097 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -51.18 -47.81 62.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 122.656 1.217 . . . . 0.0 108.816 172.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -54.82 -52.32 63.07 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 128.757 2.823 . . . . 0.0 112.058 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -72.05 -14.35 61.84 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.59 0.632 . . . . 0.0 112.474 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.4 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 32.1 m-85 -98.33 -5.3 33.15 Favored 'General case' 0 C--N 1.337 0.037 0 C-N-CA 123.255 0.622 . . . . 0.0 110.233 172.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.0 mp -93.31 -48.15 6.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 173.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -55.86 -25.1 40.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.956 0.502 . . . . 0.0 110.89 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . 0.286 20.3 ttm180 -65.1 -20.64 66.57 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.988 2.515 . . . . 0.0 113.64 -178.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -144.56 29.95 1.24 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.975 0.91 . . . . 0.0 110.217 -175.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 61.82 36.6 15.99 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.061 0.545 . . . . 0.0 112.059 176.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.424 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.8 m95 61.05 42.71 12.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.854 1.261 . . . . 0.0 111.884 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -95.35 112.48 24.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.0 tt -69.93 -16.71 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.886 -171.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.77 -43.28 12.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -67.12 -39.23 86.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.601 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.4 -31.17 70.33 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.808 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.39 -28.2 60.99 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.906 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.85 -38.4 53.83 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.159 176.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.594 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 19.7 t70 -72.36 -41.75 66.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.916 -0.49 . . . . 0.0 110.995 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.4 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 43.8 t80 -68.3 -36.66 79.67 Favored 'General case' 0 N--CA 1.453 -0.296 0 O-C-N 121.581 -0.699 . . . . 0.0 111.375 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -74.97 -9.16 58.27 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -90.95 -11.91 37.6 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.61 0.187 . . . . 0.0 111.018 174.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.594 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -111.74 -39.95 4.44 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 122.882 0.473 . . . . 0.0 112.119 -176.002 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -104.55 -40.32 6.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.973 0.509 . . . . 0.0 111.838 -172.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.9 mm -86.83 -13.58 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.909 0.385 . . . . 0.0 110.187 176.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -71.83 -3.38 55.17 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 123.667 0.651 . . . . 0.0 112.709 -178.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.9 t -137.27 27.73 2.84 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 123.659 0.784 . . . . 0.0 109.83 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -115.85 -39.48 3.48 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.201 1.001 . . . . 0.0 111.327 -175.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.4 p -123.17 27.22 7.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.477 1.111 . . . . 0.0 109.947 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -67.49 110.68 3.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.657 -178.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 45.55 29.44 0.63 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 126.207 1.803 . . . . 0.0 114.42 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.091 -0.957 . . . . 0.0 111.241 178.895 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 CA--C 1.532 0.26 0 CA-C-O 121.35 0.595 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -96.3 113.5 25.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.814 -0.554 . . . . 0.0 109.85 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 8' ' ' ARG . 42.8 mmt-85 -81.53 25.58 0.51 Allowed 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.888 1.275 . . . . 0.0 112.626 -176.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -146.7 12.61 1.15 Allowed 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.679 1.191 . . . . 0.0 110.474 -176.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -156.68 -21.63 0.1 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.937 0.895 . . . . 0.0 112.808 -174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 58.94 28.42 17.58 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.405 1.082 . . . . 0.0 112.327 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.557 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.0 OUTLIER 35.54 172.58 0.0 OUTLIER Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 129.907 3.283 . . . . 0.0 116.341 -177.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -74.15 -27.37 11.81 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.307 2.672 . . . . 0.0 110.513 172.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.407 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 47.5 mt-10 -89.14 -46.37 8.87 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.504 -1.68 . . . . 0.0 109.837 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.9 OUTLIER -70.46 -13.94 62.33 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 125.022 1.329 . . . . 0.0 110.223 -172.039 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -81.43 -12.31 58.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 179.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.19 -50.5 2.9 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.281 169.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.7 mt -56.06 -51.94 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.593 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.547 ' HA ' HG22 ' A' ' 22' ' ' THR . 20.0 mt-10 -74.99 -19.64 60.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 118.514 -1.274 . . . . 0.0 110.775 -173.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -82.1 -32.31 30.28 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -81.58 -56.26 4.13 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.783 -175.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.547 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -58.27 -28.69 65.18 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.409 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -82.92 -26.32 31.59 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 118.856 0.753 . . . . 0.0 111.629 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.4 tp -86.49 -18.65 31.08 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.097 0.559 . . . . 0.0 111.686 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -111.28 -4.17 15.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.149 0.58 . . . . 0.0 111.228 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt 63.4 10.35 4.73 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.558 0.536 . . . . 0.0 111.642 169.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.4 t -95.04 -170.73 2.26 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.967 0.907 . . . . 0.0 110.569 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -84.71 144.65 42.77 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 123.149 0.58 . . . . 0.0 110.454 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -56.06 -24.45 49.17 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.652 2.901 . . . . 0.0 114.098 -177.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -81.51 -18.8 43.81 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 117.901 0.319 . . . . 0.0 110.481 -179.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -81.99 -34.62 12.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 174.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.1 t -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 57.0 ttt85 -47.63 -54.88 10.64 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 124.541 1.136 . . . . 0.0 110.767 177.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -66.59 -18.79 65.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -176.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -94.58 -21.75 18.64 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.462 1.028 . . . . 0.0 109.976 175.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.1 mp -74.18 -37.2 64.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 176.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 78.0 mt-30 -66.84 -16.67 64.45 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.124 -0.36 . . . . 0.0 111.801 177.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -84.13 -9.55 58.49 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.183 0.593 . . . . 0.0 110.912 177.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -141.45 26.84 1.93 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.796 0.439 . . . . 0.0 111.706 -171.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 53.62 33.01 15.53 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.605 0.762 . . . . 0.0 112.533 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.407 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 16.2 m95 60.44 33.6 20.63 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.533 1.133 . . . . 0.0 112.379 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -88.82 110.77 21.32 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 172.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.5 tt -69.46 -16.58 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 C-N-CA 119.758 -0.777 . . . . 0.0 112.23 -171.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -85.04 -42.79 14.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.7 -39.74 80.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.815 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.9 -27.66 62.01 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.68 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.1 mt -75.63 -33.59 60.51 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -70.08 -37.46 75.45 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.426 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 24.2 t0 -70.94 -32.14 68.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.298 -0.251 . . . . 0.0 110.713 -178.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -80.6 -35.73 33.73 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.479 -0.763 . . . . 0.0 111.758 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -64.34 -12.75 45.3 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 173.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.484 ' C ' ' HE3' ' A' ' 53' ' ' LYS . 29.2 t70 -93.69 -8.6 40.42 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 175.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.484 ' HE3' ' C ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -113.39 -58.15 2.19 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.342 0.657 . . . . 0.0 110.776 -176.444 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 37.95 27.88 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.314 2.246 . . . . 0.0 114.858 -172.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.4 mm -64.81 -15.07 17.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 123.523 0.729 . . . . 0.0 110.41 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.416 ' HA2' ' CE2' ' A' ' 58' ' ' PHE . . . -74.5 9.6 10.11 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 123.771 0.701 . . . . 0.0 113.037 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.5 t -88.13 20.17 3.32 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.937 0.895 . . . . 0.0 112.735 -175.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.416 ' CE2' ' HA2' ' A' ' 56' ' ' GLY . 0.1 OUTLIER -61.71 -43.04 99.61 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 121.924 -0.485 . . . . 0.0 111.691 -173.605 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.5 p -90.18 32.51 0.92 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.247 0.619 . . . . 0.0 112.427 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -114.31 4.56 15.46 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.845 0.831 . . . . 0.0 111.358 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -92.17 13.99 17.44 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.42 178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 59.8 t . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.006 1.322 . . . . 0.0 109.878 -178.993 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.6 mt . . . . . 0 N--CA 1.454 -0.226 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -62.23 142.93 57.43 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.567 0.747 . . . . 0.0 110.563 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.489 ' H ' ' HD2' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -131.59 23.14 4.7 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.748 0.819 . . . . 0.0 112.357 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -145.44 18.54 1.53 Allowed 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.308 1.043 . . . . 0.0 111.384 -172.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -149.15 -29.3 0.26 Allowed 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 122.746 0.418 . . . . 0.0 112.035 -174.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 51.21 -129.45 2.28 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-O 123.102 1.43 . . . . 0.0 109.746 176.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -169.36 166.95 5.72 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 112.115 -2.311 . . . . 0.0 109.903 -174.666 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -66.67 -25.66 46.66 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 124.21 3.274 . . . . 0.0 110.039 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.467 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 41.4 mt-10 -90.93 -47.35 7.64 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 113.41 -1.723 . . . . 0.0 109.873 178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.618 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -70.12 -14.06 62.48 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.42 0.688 . . . . 0.0 110.828 -173.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.25 -14.61 59.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 178.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.77 -56.68 2.33 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.052 170.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.1 mt -52.24 -50.08 38.38 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.57 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.9 mt-10 -76.16 -20.31 57.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 118.272 -1.371 . . . . 0.0 110.695 -174.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -82.41 -26.97 32.3 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -87.1 -52.7 5.28 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -174.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.57 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.9 t -58.87 -30.15 67.52 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.195 178.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -84.23 -28.54 27.19 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 118.834 0.743 . . . . 0.0 111.992 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.4 tt -84.33 -22.57 30.57 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.094 -0.379 . . . . 0.0 111.209 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.3 p -112.59 -3.23 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 123.298 0.639 . . . . 0.0 111.77 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp 63.89 9.24 4.37 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.481 0.488 . . . . 0.0 112.032 169.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.4 t -90.19 -168.86 2.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.991 0.916 . . . . 0.0 109.934 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -86.6 144.38 37.44 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 122.893 0.477 . . . . 0.0 110.365 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -56.97 -26.55 68.67 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.445 2.763 . . . . 0.0 113.498 -177.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -79.51 -18.89 50.95 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.15 0.432 . . . . 0.0 110.797 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.0 t -82.81 -33.56 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.0 m -60.2 -46.77 88.61 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 39.5 ttt-85 -60.47 -37.54 81.33 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 125.479 1.512 . . . . 0.0 112.088 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -86.19 -8.2 57.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 119.519 1.054 . . . . 0.0 113.114 -175.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.407 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 14.8 m-85 -99.73 -22.64 15.3 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 170.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 24.7 mt -75.47 -34.85 60.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.458 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 50.6 mt-30 -68.33 -11.89 60.22 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -94.98 -5.56 44.37 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.796 0.438 . . . . 0.0 110.955 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -136.84 27.26 2.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.528 0.731 . . . . 0.0 111.408 -175.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 54.39 31.32 14.32 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.661 0.784 . . . . 0.0 112.35 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.467 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.1 m95 58.97 31.85 21.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.532 1.133 . . . . 0.0 112.649 -178.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.93 117.41 23.91 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 173.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.4 tt -73.62 -17.1 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 118.802 -1.159 . . . . 0.0 112.013 -169.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -85.68 -41.89 14.76 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.83 -40.15 79.62 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.175 -0.92 . . . . 0.0 109.683 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.14 -27.78 62.83 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.541 -177.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 25.6 mt -75.53 -31.63 60.17 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.361 177.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -72.94 -31.7 64.77 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.069 177.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.59 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 38.7 t70 -71.94 -34.79 69.31 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 56.5 t80 -71.65 -44.84 63.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.796 -0.565 . . . . 0.0 111.268 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -64.89 -16.28 63.04 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 117.814 0.279 . . . . 0.0 110.39 176.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.6 -11.56 55.75 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 122.636 0.374 . . . . 0.0 110.777 177.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.59 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.2 OUTLIER -110.56 -12.08 14.39 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.416 0.687 . . . . 0.0 112.367 -174.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -78.26 -5.75 52.91 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.43 0.559 . . . . 0.0 111.04 175.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.5 mm -69.08 -14.65 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 C-N-CA 123.373 0.669 . . . . 0.0 110.601 -179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.83 9.4 86.53 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.4 t -79.63 27.28 0.28 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.825 0.821 . . . . 0.0 111.195 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -87.38 -29.95 21.12 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.956 0.902 . . . . 0.0 111.145 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.5 p -97.28 23.58 7.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.837 0.855 . . . . 0.0 109.888 175.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -77.28 1.62 18.13 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.888 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -120.7 19.48 11.85 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.918 1.287 . . . . 0.0 111.197 177.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.607 1.963 . . . . 0.0 111.918 -178.83 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.7 tt . . . . . 0 N--CA 1.452 -0.372 0 CA-C-O 121.543 0.687 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -63.25 119.1 8.97 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.384 0.673 . . . . 0.0 109.895 -176.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.1 mmm-85 -99.65 24.81 7.8 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.731 1.212 . . . . 0.0 111.88 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 49.13 28.83 2.28 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.921 1.288 . . . . 0.0 112.601 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -153.4 -32.2 0.12 Allowed 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 122.762 0.425 . . . . 0.0 111.304 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.73 103.66 2.1 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 122.305 1.05 . . . . 0.0 109.957 176.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.489 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 1.1 t -52.26 165.45 0.51 Allowed Pre-proline 0 N--CA 1.452 -0.337 0 C-N-CA 126.127 1.771 . . . . 0.0 112.28 174.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -63.5 -25.98 70.13 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.805 3.004 . . . . 0.0 110.043 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.46 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 32.9 mt-10 -91.36 -46.37 8.06 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 113.796 -1.547 . . . . 0.0 109.773 177.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.6 mm-40 -70.37 -12.5 61.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 123.343 0.402 . . . . 0.0 111.796 -174.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -79.36 -15.18 58.32 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.25 -51.56 2.86 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.794 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.6 mt -56.16 -48.93 78.51 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.948 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' HG22 ' A' ' 22' ' ' THR . 16.7 mt-10 -75.67 -21.25 57.81 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 118.957 -1.097 . . . . 0.0 111.374 -175.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 12.5 t -81.3 -34.68 31.8 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -76.3 -62.33 1.65 Allowed 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.111 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.535 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.9 t -54.44 -29.66 50.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.867 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 m -81.2 -25.64 36.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 119.056 0.844 . . . . 0.0 112.073 175.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 57.6 tp -89.97 -22.53 21.89 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.927 0.491 . . . . 0.0 112.077 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.6 p -109.02 -3.75 17.2 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 123.238 0.615 . . . . 0.0 111.056 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt 63.51 13.5 7.25 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.707 0.403 . . . . 0.0 111.854 168.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.7 p -87.38 -169.5 2.64 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.627 0.771 . . . . 0.0 110.65 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.458 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.5 t70 -88.15 144.39 34.29 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 52.2 Cg_exo -59.29 -7.93 5.9 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 123.995 3.13 . . . . 0.0 114.683 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.552 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 10.7 mmpt? -97.95 -10.76 23.98 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.657 0.662 . . . . 0.0 111.208 176.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 59.8 t -91.53 -38.72 10.86 Favored 'Isoleucine or valine' 0 C--N 1.337 0.06 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.2 p -53.4 -44.03 68.36 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 122.324 1.059 . . . . 0.0 109.157 174.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.461 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 62.8 ttt-85 -63.85 -33.14 75.02 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 128.101 2.56 . . . . 0.0 112.066 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -88.73 -9.87 50.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 119.224 0.92 . . . . 0.0 112.522 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -97.58 -24.64 15.46 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 22.8 mt -74.2 -35.56 63.95 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.2 mt-30 -67.38 -12.81 61.15 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -94.63 -7.6 40.42 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.981 0.513 . . . . 0.0 111.348 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -133.41 27.18 4.1 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.291 0.636 . . . . 0.0 111.144 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 53.21 31.16 11.06 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.668 0.787 . . . . 0.0 112.223 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 13.7 m95 58.43 33.21 22.93 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.593 1.157 . . . . 0.0 112.275 -178.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -84.07 116.01 22.65 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.21 -16.96 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.929 -169.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -85.04 -41.18 16.03 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -69.74 -40.37 76.23 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.679 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.48 -27.68 62.43 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 122.703 0.401 . . . . 0.0 111.364 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.9 mt -73.68 -34.31 64.83 Favored 'General case' 0 C--N 1.339 0.137 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -73.11 -30.52 63.7 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -17.52 59.38 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 122.579 0.352 . . . . 0.0 111.759 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.28 -36.17 11.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.477 1.111 . . . . 0.0 111.621 174.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.1 m-30 -75.05 -5.13 42.43 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.239 -0.288 . . . . 0.0 110.372 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.28 -16.86 44.64 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 122.677 0.391 . . . . 0.0 111.122 175.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -96.97 -33.65 11.5 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.994 0.917 . . . . 0.0 110.199 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -132.61 97.25 4.02 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 122.283 1.039 . . . . 0.0 109.215 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mm -63.15 -19.87 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 113.877 -1.51 . . . . 0.0 110.574 178.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 87.14 -3.75 86.64 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.496 0.569 . . . . 0.0 112.103 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -151.68 28.41 0.62 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 117.453 0.626 . . . . 0.0 111.317 179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -122.8 -125.55 0.26 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 124.746 1.218 . . . . 0.0 107.838 -176.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.5 p -97.63 28.27 3.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.615 0.766 . . . . 0.0 111.925 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -96.12 -2.19 47.02 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 124.038 0.935 . . . . 0.0 112.088 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -95.36 15.4 19.57 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 125.687 1.595 . . . . 0.0 111.315 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.89 1.276 . . . . 0.0 109.897 -178.265 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.482 ' O ' HG22 ' A' ' 6' ' ' ILE . 24.2 mm . . . . . 0 CA--C 1.531 0.238 0 CA-C-O 122.339 1.066 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 9' ' ' LYS . 34.9 mmtp -82.82 42.58 0.79 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.073 0.949 . . . . 0.0 111.266 -178.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.5 ptt85 -74.64 24.45 0.09 Allowed 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 124.269 1.027 . . . . 0.0 112.009 178.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.46 ' H ' ' C ' ' A' ' 7' ' ' LYS . 86.8 mttt -144.47 14.7 1.61 Allowed 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.376 1.071 . . . . 0.0 111.161 -172.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -148.47 -24.49 0.33 Allowed 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 59.77 69.96 0.67 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 122.518 1.151 . . . . 0.0 110.393 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -51.61 -175.08 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.471 0 C-N-CA 127.654 2.382 . . . . 0.0 110.726 169.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 90.3 Cg_endo -83.43 -21.11 4.53 Favored 'Trans proline' 0 N--CA 1.451 -1.0 1 C-N-CA 125.534 4.156 . . . . 0.0 109.805 -168.142 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.509 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 20.9 mt-10 -98.81 -28.21 13.59 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.312 175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.523 HE21 ' N ' ' A' ' 15' ' ' GLN . 1.2 mm-40 -79.07 -14.38 59.19 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -175.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -81.05 -11.18 59.57 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' PHE . . . -112.67 -49.16 2.96 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.072 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.42 -47.93 88.94 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 CA-C-N 118.843 0.747 . . . . 0.0 111.77 -178.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 22' ' ' THR . 24.3 mt-10 -75.14 -20.3 59.47 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.827 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -84.41 -28.9 26.59 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 17' ' ' ALA . 27.7 t80 -83.66 -54.12 5.16 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -175.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 19' ' ' GLU . 2.3 t -56.71 -30.37 63.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.424 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.8 m -83.4 -26.95 29.97 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 118.894 0.77 . . . . 0.0 111.811 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 52.4 tp -87.24 -16.41 35.32 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.0 p -119.95 -1.49 10.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 122.806 0.442 . . . . 0.0 111.721 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp 63.96 10.97 5.7 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 169.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.2 p -89.04 -168.58 2.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.159 0.584 . . . . 0.0 110.355 178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.442 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 14.7 t70 -87.79 143.88 34.2 Favored Pre-proline 0 CA--C 1.532 0.274 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 77.6 Cg_exo -55.61 -24.06 43.27 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.303 2.669 . . . . 0.0 113.71 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -78.68 -19.25 52.93 Favored 'General case' 0 CA--C 1.521 -0.151 0 O-C-N 121.867 -0.52 . . . . 0.0 110.738 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -82.66 -32.67 10.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 175.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.2 m -62.5 -47.35 84.35 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 175.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.481 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 46.3 ttt85 -57.5 -39.18 75.91 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.968 1.707 . . . . 0.0 111.948 178.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -81.26 -19.06 43.89 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 119.527 1.058 . . . . 0.0 113.234 -177.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -91.63 -24.61 19.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 119.258 0.935 . . . . 0.0 109.861 176.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.3 mp -70.19 -36.8 74.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 79.7 mt-30 -67.57 -12.61 60.78 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -93.8 -7.06 44.49 Favored 'General case' 0 CA--C 1.523 -0.096 0 C-N-CA 123.169 0.588 . . . . 0.0 111.432 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -134.47 25.51 3.77 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.252 0.621 . . . . 0.0 111.337 -175.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 54.08 31.62 14.12 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.363 0.665 . . . . 0.0 111.729 -178.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.509 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 14.5 m95 59.24 32.84 22.31 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.816 1.246 . . . . 0.0 112.416 -177.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -85.3 110.76 19.31 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 5.4 tt -69.45 -16.61 20.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.031 -170.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -85.62 -42.57 14.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -68.13 -39.38 82.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.488 178.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.83 61.01 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.598 -177.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.1 mt -73.18 -33.35 65.38 Favored 'General case' 0 C--N 1.339 0.123 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -72.09 -32.91 67.46 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.589 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 33.8 t70 -70.02 -37.68 75.68 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.344 -0.223 . . . . 0.0 110.457 178.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -73.26 -41.04 64.14 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.845 -0.534 . . . . 0.0 111.657 177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -70.12 -9.48 55.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.093 0.406 . . . . 0.0 110.37 175.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -90.55 -14.34 32.76 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.838 0.455 . . . . 0.0 110.662 175.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.589 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -106.34 -7.11 17.86 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -171.208 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.97 -7.92 53.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 118.01 0.368 . . . . 0.0 111.226 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.5 mt -141.66 -47.51 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.866 0.866 . . . . 0.0 109.461 -179.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.43 ' HA2' ' CE2' ' A' ' 58' ' ' PHE . . . -87.8 81.86 1.6 Allowed Glycine 0 C--N 1.335 0.503 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 15.4 t -87.96 15.15 7.62 Favored 'General case' 0 CA--C 1.527 0.087 0 CA-C-O 121.724 0.773 . . . . 0.0 112.176 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.43 ' CE2' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -81.2 -40.6 23.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.754 178.324 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.4 p -87.4 35.54 0.72 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.991 0.917 . . . . 0.0 111.36 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -121.17 11.69 10.92 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.975 0.91 . . . . 0.0 111.549 -177.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -84.68 24.64 1.0 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.082 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 C--O 1.252 1.2 0 CA-C-O 117.43 -1.271 . . . . 0.0 109.438 -178.833 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 N--CA 1.454 -0.233 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -69.75 159.61 33.24 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.505 0.669 . . . . 0.0 110.717 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.4 mmm-85 -113.91 26.82 10.01 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.411 1.085 . . . . 0.0 108.984 170.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 52.09 48.51 22.57 Favored 'General case' 0 C--N 1.338 0.081 0 C-N-CA 123.619 0.768 . . . . 0.0 110.93 -178.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -105.49 -0.64 25.72 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 124.249 1.02 . . . . 0.0 110.308 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 62.82 70.22 0.56 Allowed 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.493 1.517 . . . . 0.0 110.698 -177.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.54 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -54.77 -178.6 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.595 0 C-N-CA 127.046 2.138 . . . . 0.0 110.877 172.044 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.54 ' CD ' ' CB ' ' A' ' 12' ' ' SER . 22.9 Cg_exo -66.98 -30.54 39.13 Favored 'Trans proline' 0 N--CA 1.456 -0.716 1 C-N-CA 125.479 4.119 . . . . 0.0 111.898 -173.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.468 ' HB3' ' CZ3' ' A' ' 41' ' ' TRP . 57.7 mt-10 -92.7 -35.27 13.57 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.349 176.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -75.14 -8.44 56.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.13 0.572 . . . . 0.0 111.399 -175.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -85.95 -14.68 43.96 Favored 'General case' 0 CA--C 1.52 -0.18 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.02 -47.7 3.39 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.768 171.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.6 mt -58.16 -51.81 66.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 119.073 -0.489 . . . . 0.0 111.706 -178.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.477 ' HA ' HG22 ' A' ' 22' ' ' THR . 23.5 mt-10 -70.8 -23.39 62.37 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 118.779 -1.168 . . . . 0.0 111.164 -175.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.2 t -81.04 -34.29 32.92 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -79.12 -61.3 2.06 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.403 -176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.477 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.5 t -53.75 -28.73 36.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.079 0.951 . . . . 0.0 112.618 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.5 m -83.31 -28.08 29.32 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 119.078 0.854 . . . . 0.0 111.812 175.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.2 tp -84.28 -16.7 42.18 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.055 0.542 . . . . 0.0 111.781 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.4 p -118.51 -2.04 11.1 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 122.875 0.47 . . . . 0.0 111.752 -179.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp 63.23 10.4 4.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 169.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -89.17 -174.55 4.47 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.812 0.445 . . . . 0.0 110.745 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -80.92 150.46 69.01 Favored Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 122.271 0.228 . . . . 0.0 110.89 178.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -57.4 -22.55 50.71 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -86.72 -10.08 54.5 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.2 t -97.85 -36.34 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.099 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.8 p -54.9 -36.97 65.76 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 122.341 1.067 . . . . 0.0 109.411 174.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 31.4 ttt85 -67.73 -54.16 21.61 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 127.909 2.483 . . . . 0.0 110.942 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -67.29 -10.0 46.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.415 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 28.5 m-85 -105.24 -9.3 17.77 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 118.65 0.659 . . . . 0.0 110.442 174.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 18.8 mt -86.44 -38.77 17.0 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 171.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.411 ' HG2' ' HE1' ' A' ' 41' ' ' TRP . 81.3 mt-30 -63.7 -16.26 60.61 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.334 0.654 . . . . 0.0 112.761 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -78.32 -15.86 58.3 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.037 0.535 . . . . 0.0 111.605 -178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -143.67 36.52 1.31 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.746 0.419 . . . . 0.0 111.812 -173.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 57.66 33.34 23.11 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CZ3' ' HB3' ' A' ' 14' ' ' GLU . 13.9 m95 60.52 39.74 17.77 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.323 1.049 . . . . 0.0 112.306 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -89.6 111.18 22.05 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 174.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -68.19 -16.59 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.932 -169.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -86.17 -42.33 13.93 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.71 -41.29 83.79 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.817 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.83 74.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.748 0.819 . . . . 0.0 111.63 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.07 -33.49 63.69 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.148 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.8 -36.7 65.03 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.058 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.587 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 20.5 t70 -68.64 -43.52 76.14 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 41.8 t80 -64.06 -41.3 97.4 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.954 -0.466 . . . . 0.0 111.27 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -72.06 -4.07 26.66 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.171 0.189 . . . . 0.0 111.031 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -96.82 -5.87 37.33 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 122.401 -0.187 . . . . 0.0 111.343 173.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.587 ' HE3' ' O ' ' A' ' 49' ' ' ASP . 0.0 OUTLIER -117.22 -29.88 5.77 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 123.459 0.703 . . . . 0.0 112.403 -174.837 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' H ' ' HG3' ' A' ' 54' ' ' GLU . 0.6 OUTLIER -81.71 -3.15 52.91 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.789 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 36.7 mm -60.58 -21.99 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 123.901 0.881 . . . . 0.0 110.532 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.94 3.01 90.71 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 122.104 -0.373 . . . . 0.0 112.879 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.8 t -90.33 23.76 2.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.901 0.858 . . . . 0.0 110.855 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -84.66 -27.12 27.32 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.012 0.925 . . . . 0.0 111.319 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.9 p -85.8 21.56 1.86 Allowed 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.437 0.695 . . . . 0.0 110.653 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -90.94 1.29 57.15 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.545 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -92.56 13.41 19.93 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 124.889 1.275 . . . . 0.0 111.62 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.251 1.166 0 CA-C-O 117.074 -1.441 . . . . 0.0 110.931 -178.878 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.6 tt . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.653 0.739 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -56.88 133.28 54.42 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.566 0.747 . . . . 0.0 109.908 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -121.51 64.07 0.9 Allowed 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.472 1.109 . . . . 0.0 109.837 -172.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 48.17 49.55 17.37 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 114.672 -1.149 . . . . 0.0 111.778 176.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -98.73 -7.06 28.32 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.5 0.72 . . . . 0.0 110.167 -176.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 50.62 73.47 0.28 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.463 1.505 . . . . 0.0 111.424 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.576 ' HB3' ' HB2' ' A' ' 15' ' ' GLN . 0.4 OUTLIER -44.67 164.58 0.17 Allowed Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 125.96 1.704 . . . . 0.0 112.47 171.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -62.09 -25.72 77.59 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.134 3.222 . . . . 0.0 109.69 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.445 ' HA ' ' CZ3' ' A' ' 41' ' ' TRP . 44.9 mt-10 -90.15 -43.96 10.1 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 113.601 -1.636 . . . . 0.0 109.877 177.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.576 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -73.24 -15.75 61.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.644 0.59 . . . . 0.0 110.926 -172.037 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -76.47 -13.29 60.11 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.07 -54.56 2.6 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.094 170.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.409 ' O ' HG22 ' A' ' 22' ' ' THR . 11.3 mt -53.44 -52.26 33.96 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.58 0 CA-C-O 118.854 -0.593 . . . . 0.0 112.181 -178.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.551 ' HA ' HG22 ' A' ' 22' ' ' THR . 18.7 mt-10 -74.07 -21.0 60.1 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.936 -173.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.8 t -80.18 -33.39 38.32 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -80.74 -59.51 2.65 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.207 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.551 HG22 ' HA ' ' A' ' 19' ' ' GLU . 1.8 t -55.62 -28.84 57.51 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.377 1.071 . . . . 0.0 112.323 179.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 m -82.05 -26.24 33.9 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 119.2 0.909 . . . . 0.0 111.898 174.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.6 tp -86.87 -22.69 25.6 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.133 0.573 . . . . 0.0 112.051 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 43.4 p -109.0 -3.52 17.39 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 123.509 0.724 . . . . 0.0 110.864 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.8 mmtt 64.0 12.34 6.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.421 0.451 . . . . 0.0 112.121 168.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.9 p -90.02 -165.23 1.3 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.43 0.692 . . . . 0.0 111.041 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -92.7 145.01 29.54 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.16 0.584 . . . . 0.0 109.628 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.09 -25.59 46.15 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.423 2.749 . . . . 0.0 113.807 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.4 -11.73 59.66 Favored 'General case' 0 C--O 1.228 -0.071 0 CA-C-N 118.147 0.431 . . . . 0.0 111.203 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 49.9 t -90.74 -37.53 9.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.087 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 176.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 29.1 t -58.35 -44.67 88.85 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 37' ' ' GLN . 55.6 ttt85 -48.87 -58.28 5.09 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 125.066 1.346 . . . . 0.0 110.603 175.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -68.18 -13.4 62.21 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 50' ' ' TYR . 21.3 m-85 -100.97 -18.03 16.5 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.225 0.921 . . . . 0.0 110.118 175.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 32.2 mt -79.67 -35.28 39.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 80.4 mt-30 -66.05 -17.22 64.55 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.507 0.323 . . . . 0.0 111.461 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.5 mtp85 -83.0 -10.18 58.91 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.385 0.674 . . . . 0.0 110.941 177.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -141.28 27.91 1.89 Allowed 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.7 0.4 . . . . 0.0 111.864 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 54.32 31.25 14.0 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.518 0.727 . . . . 0.0 112.283 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CZ3' ' HA ' ' A' ' 14' ' ' GLU . 14.5 m95 60.09 34.31 21.27 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.52 1.128 . . . . 0.0 112.827 -178.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -86.91 116.39 24.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.1 tt -72.74 -17.37 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 118.958 -1.097 . . . . 0.0 111.898 -170.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -84.79 -42.27 15.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -176.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.0 m-30 -68.97 -39.76 79.27 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.63 63.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.432 -177.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 31.0 mt -75.71 -33.78 60.34 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 118.014 0.37 . . . . 0.0 110.191 178.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -71.79 -35.34 69.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.234 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.598 ' O ' ' HE2' ' A' ' 53' ' ' LYS . 27.2 t70 -70.28 -42.86 71.55 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.707 0.289 . . . . 0.0 110.35 178.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.417 ' HA ' ' CE2' ' A' ' 35' ' ' TYR . 47.2 t80 -64.43 -38.49 91.21 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 121.548 -0.72 . . . . 0.0 111.408 177.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -77.57 -5.6 50.75 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 122.256 0.222 . . . . 0.0 110.841 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -91.03 -16.56 27.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 117.777 0.262 . . . . 0.0 111.206 174.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.598 ' HE2' ' O ' ' A' ' 49' ' ' ASP . 0.1 OUTLIER -98.44 -22.74 15.88 Favored 'General case' 0 C--O 1.231 0.08 0 C-N-CA 123.685 0.794 . . . . 0.0 111.268 -177.817 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -144.99 83.26 1.69 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 122.519 1.152 . . . . 0.0 108.653 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.2 mt -70.02 -17.09 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 113.864 -1.516 . . . . 0.0 110.863 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 0.64 74.95 Favored Glycine 0 CA--C 1.525 0.657 0 C-N-CA 123.796 0.712 . . . . 0.0 111.698 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.5 t -140.26 23.27 2.37 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 123.726 0.81 . . . . 0.0 110.606 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -92.41 -34.35 14.18 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.231 1.012 . . . . 0.0 110.597 -177.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 22.5 p -95.09 24.72 4.68 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.714 0.806 . . . . 0.0 110.036 173.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -68.73 110.72 4.44 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.925 0.869 . . . . 0.0 110.379 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 44.65 26.98 0.21 Allowed 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.851 2.461 . . . . 0.0 114.95 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.8 m . . . . . 0 C--O 1.25 1.118 0 CA-C-O 117.055 -1.45 . . . . 0.0 111.345 177.744 . . . . . . . . 0 0 . 1 stop_ save_