data_1n0z_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 1n0z _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.526 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 20.3 p-90 -130.88 170.53 14.3 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.7 0.286 . . . . 0.0 111.206 -174.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.504 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.1 pt -121.44 155.45 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.174 175.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -41.85 142.78 1.05 Allowed Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 124.022 0.826 . . . . 0.0 111.984 -179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.526 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.3 Cg_exo -61.72 -21.25 71.71 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.653 2.236 . . . . 0.0 112.048 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -103.8 149.43 25.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.903 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.37 -6.17 57.86 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.319 -173.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -65.74 -41.46 92.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.439 0.638 . . . . 0.0 109.733 175.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.42 -79.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.357 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.14 30.01 70.03 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 6.8 t30 -63.25 139.1 58.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.484 -0.358 . . . . 0.0 110.322 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 25' ' ' VAL . 1.4 m -78.96 102.33 4.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.406 0.622 . . . . 0.0 109.334 173.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.682 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 5.7 m120 -79.03 156.0 28.58 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.374 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.506 ' HB3' ' HG2' ' A' ' 30' ' ' ARG . 59.0 t80 -45.41 -82.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.03 0.831 . . . . 0.0 111.365 178.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 178.39 -66.65 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.97 53.72 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.768 173.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.506 ' HG2' ' HB3' ' A' ' 27' ' ' PHE . 55.0 mmt-85 -111.48 112.33 23.98 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.924 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -8.08 57.72 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.228 0.537 . . . . 0.0 109.722 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 1.5 m -140.56 152.41 45.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.509 174.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.753 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.6 t -53.63 152.7 4.92 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.494 0.664 . . . . 0.0 111.657 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.04 -18.93 32.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.355 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.31 -52.06 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.151 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.409 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 58.0 m -79.41 -53.86 6.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.39 0.614 . . . . 0.0 111.508 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.753 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 94.08 13.83 53.41 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -167.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.429 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.2 OUTLIER -81.28 145.14 31.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.219 -0.491 . . . . 0.0 109.877 178.071 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -69.83 143.99 52.72 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -171.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -59.19 107.22 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.042 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 . . . . . 0 C--O 1.237 0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 109.926 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.611 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 3.3 p-90 -156.48 -166.8 2.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.4 -75.48 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.188 0.518 . . . . 0.0 109.87 175.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 44.7 t -142.97 155.24 62.51 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 174.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.611 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 17.9 Cg_exo -68.42 -14.2 39.41 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.983 1.789 . . . . 0.0 110.975 176.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.441 ' OD1' ' HG2' ' A' ' 21' ' ' LYS . 2.6 t0 -106.59 177.62 4.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.794 177.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.79 -10.94 9.44 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.838 0.352 . . . . 0.0 110.545 -179.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.441 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 9.0 pttm -85.21 -2.87 58.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.542 177.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.0 t -119.41 -86.76 0.64 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.568 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 59.64 4.61 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.809 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.481 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 48.7 t30 -76.21 159.97 30.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.663 0.268 . . . . 0.0 110.723 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.85 62.1 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.228 0.537 . . . . 0.0 110.865 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.42 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 78.7 m-20 -89.53 125.7 35.3 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.409 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -84.15 171.51 12.77 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.03 -51.78 16.54 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -70.1 -12.48 61.63 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.563 ' O ' ' HZ2' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -79.23 86.46 5.0 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.504 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -0.79 12.66 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -142.06 135.39 29.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.75 0.31 . . . . 0.0 111.559 -177.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HA ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 t -69.2 138.4 54.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.252 0.548 . . . . 0.0 109.886 174.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.441 ' HA ' HH21 ' A' ' 38' ' ' ARG . 0.8 OUTLIER -100.43 2.52 42.3 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.637 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.481 ' HB2' ' HB2' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -104.87 -58.88 1.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.317 -174.627 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 24.7 p -93.26 -61.24 1.61 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.192 0.52 . . . . 0.0 111.661 -171.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 36' ' ' CYS . . . -133.5 -86.0 0.27 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.879 -175.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.441 HH21 ' HA ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -175.73 -132.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.681 0.24 . . . . 0.0 111.188 -169.175 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.59 145.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.77 0.828 . . . . 0.0 113.187 -173.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -64.34 104.36 0.76 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.968 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.422 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.039 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.496 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 8.8 p-90 -136.96 177.91 7.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.944 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.791 ' HB ' ' HA2' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -111.88 -108.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.155 -176.675 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 4.1 t -134.89 137.62 27.7 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.496 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.4 Cg_exo -62.55 -26.69 76.16 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.725 2.283 . . . . 0.0 112.395 -171.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.529 ' HB3' ' HD3' ' A' ' 20' ' ' LYS . 6.8 t0 -147.1 178.03 8.7 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.557 ' HZ1' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER 72.46 150.66 0.1 Allowed 'General case' 0 N--CA 1.432 -1.333 0 CA-C-O 122.123 0.963 . . . . 0.0 110.345 175.821 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 39.01 0.16 Allowed 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.527 172.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.514 ' H ' ' C ' ' A' ' 20' ' ' LYS . 14.2 t -77.2 -78.6 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.112 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.791 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 70.54 36.93 68.56 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.767 178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 4.8 t30 -70.73 131.2 43.5 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -77.73 99.28 2.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.476 0.655 . . . . 0.0 110.53 -177.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -85.4 151.32 24.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.447 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -48.41 -80.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 O-C-N 123.816 0.697 . . . . 0.0 111.56 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -59.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.496 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 0.5 OUTLIER -83.52 52.28 2.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.873 178.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.57 ' NH2' ' HA ' ' A' ' 34' ' ' ASP . 0.1 OUTLIER -122.46 117.57 26.29 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.515 174.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -82.69 -3.72 56.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.931 0.396 . . . . 0.0 110.824 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 9.8 m -141.84 154.98 45.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.366 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.9 t -58.36 136.46 57.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.163 0.506 . . . . 0.0 110.693 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.57 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 12.3 t70 -72.63 -11.42 60.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.349 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -108.47 -57.77 2.09 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.989 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.8 m -79.14 -37.8 37.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 111.904 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 85.54 11.45 74.7 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -171.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 133.06 36.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.4 OUTLIER -77.07 158.53 30.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.37 -174.801 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.98 78.7 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.904 172.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.709 -173.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.231 0.127 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.523 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -129.74 -10.74 4.43 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.161 0.981 . . . . 0.0 109.904 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.545 HG22 ' N ' ' A' ' 17' ' ' CYS . 7.8 mm 71.11 138.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.444 0 CA-C-N 112.751 -2.022 . . . . 0.0 109.642 -172.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.545 ' N ' HG22 ' A' ' 16' ' ' ILE . 24.7 t -42.66 146.44 0.73 Allowed Pre-proline 0 C--O 1.24 0.561 0 C-N-CA 122.832 0.453 . . . . 0.0 111.999 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.523 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -68.31 -13.78 38.62 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.42 2.08 . . . . 0.0 111.379 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -98.18 -178.72 4.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.948 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.1 11.48 11.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.014 0.435 . . . . 0.0 110.567 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -97.97 -24.07 15.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.779 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' HB3' ' A' ' 35' ' ' ARG . 59.5 m -97.06 -73.11 0.62 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.409 0.623 . . . . 0.0 111.454 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.52 37.17 78.06 Favored Glycine 0 N--CA 1.44 -1.047 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 -166.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.96 137.77 58.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.534 -0.833 . . . . 0.0 111.568 -176.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -86.62 87.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.018 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.7 166.76 21.48 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.715 -173.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -65.27 -74.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -179.09 -76.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.079 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.431 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 37.1 mmt-85 -77.45 42.79 0.36 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.067 -178.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.41 ' H ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -96.86 135.19 39.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 174.327 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 1.38 51.7 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.0 0.429 . . . . 0.0 110.504 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.98 155.63 41.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.591 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.458 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 40.7 t -67.78 155.1 40.07 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.5 176.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -17.57 17.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.373 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.64 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -88.19 -45.64 9.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.938 -178.323 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -113.45 -55.75 2.48 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.956 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.458 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 125.74 8.92 5.05 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.09 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -62.21 137.5 58.27 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -75.68 153.68 36.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.357 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -58.6 107.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.638 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 121.013 0.435 . . . . 0.0 111.482 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 . . . . . 0 CA--C 1.517 -0.297 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.514 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 23.5 p-90 -125.03 133.27 53.02 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.44 ' HB ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -69.7 -55.51 14.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.703 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 3.6 m -162.55 168.07 11.21 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.514 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 23.1 Cg_exo -64.74 -35.05 47.99 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.935 1.757 . . . . 0.0 111.19 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.699 ' HB3' ' HG2' ' A' ' 21' ' ' LYS . 29.8 t0 -155.17 163.4 40.25 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.116 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 31.78 0.16 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.937 0.399 . . . . 0.0 111.249 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.699 ' HG2' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -79.12 -38.98 34.8 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 173.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.65 -91.25 0.28 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.632 0.729 . . . . 0.0 109.408 170.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.48 64.69 0.45 Allowed Glycine 0 C--N 1.314 -0.685 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.717 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.452 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 51.4 t30 -105.8 -173.22 2.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.49 90.31 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.198 0.523 . . . . 0.0 109.676 174.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -95.3 167.49 11.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.519 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.661 ' HD2' ' HG2' ' A' ' 29' ' ' ARG . 3.9 t80 -102.22 144.05 31.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.955 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.483 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -51.11 -34.02 28.81 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.661 ' HG2' ' HD2' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -80.51 -3.84 51.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.944 0.402 . . . . 0.0 110.837 -179.208 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 15.9 mtt-85 -80.42 129.28 34.41 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.13 -12.73 40.24 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.295 0.569 . . . . 0.0 110.646 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.16 158.19 43.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.677 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.451 ' SG ' ' HD3' ' A' ' 18' ' ' PRO . 64.6 m -54.82 136.11 47.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.821 171.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.93 -41.9 18.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.894 0.378 . . . . 0.0 111.71 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -42.79 8.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.087 0.47 . . . . 0.0 110.745 -174.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.45 ' SG ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.94 -57.45 3.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.854 -176.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.31 19.94 7.29 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.487 -0.863 . . . . 0.0 114.638 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.44 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -91.91 167.37 12.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.853 0.827 . . . . 0.0 109.089 173.049 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pm0 -96.39 151.86 19.14 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 121.93 -0.482 . . . . 0.0 110.624 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.4 68.9 2.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.149 0.5 . . . . 0.0 110.071 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.767 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.234 0.285 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.692 ' HH2' HH12 ' A' ' 38' ' ' ARG . 6.6 p-90 -127.17 149.48 49.95 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.145 0.498 . . . . 0.0 110.903 -177.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.451 HG21 ' HA ' ' A' ' 25' ' ' VAL . 3.8 pt -98.8 -117.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.72 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 5.5 t -123.2 149.88 58.58 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 175.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 46.4 Cg_exo -57.18 -29.99 85.56 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.989 1.792 . . . . 0.0 112.444 -177.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.482 ' CG ' ' H ' ' A' ' 20' ' ' LYS . 18.7 t70 -110.97 -174.94 2.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.976 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 5.3 mtmm -103.27 -9.95 19.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.161 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -60.41 -37.8 82.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.112 0.482 . . . . 0.0 110.265 177.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.548 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -88.02 -79.74 0.29 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.509 0.671 . . . . 0.0 110.317 174.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.48 27.37 73.55 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -170.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -84.19 133.61 34.59 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.014 -0.593 . . . . 0.0 110.677 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.451 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -78.16 92.29 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.482 0.658 . . . . 0.0 110.492 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 34' ' ' ASP . 91.4 m-20 -79.93 -172.88 3.6 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.413 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.757 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 2.2 t80 -73.75 -131.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.09 -62.99 0.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.95 41.61 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.241 175.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.757 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -111.01 121.48 45.47 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.459 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.69 21.3 8.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.604 0.716 . . . . 0.0 109.933 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.2 m -153.99 150.69 28.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.446 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.825 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -63.54 158.5 20.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.404 0.621 . . . . 0.0 111.8 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.516 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 0.5 OUTLIER -92.9 -18.75 22.4 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.391 174.607 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.548 ' NH2' ' HA ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -104.44 -68.26 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.678 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.701 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 29.5 p -79.91 -30.4 40.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.195 0.521 . . . . 0.0 110.259 -176.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.825 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 87.72 6.68 76.23 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.881 -0.676 . . . . 0.0 113.926 168.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.701 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -73.04 166.85 22.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.633 0.717 . . . . 0.0 110.051 177.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.466 ' O ' ' HD2' ' A' ' 38' ' ' ARG . 20.3 pm0 -74.25 175.69 7.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.515 -177.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -77.52 55.08 1.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.849 0.833 . . . . 0.0 110.555 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.313 -0.995 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.393 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.352 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.486 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 39.6 p-90 -160.98 148.43 15.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.705 0.288 . . . . 0.0 110.618 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.419 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -99.92 157.12 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 1.023 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 6.2 m -47.62 144.69 4.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 123.879 0.737 . . . . 0.0 111.916 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.524 ' HG2' ' H ' ' A' ' 41' ' ' THR . 11.8 Cg_exo -69.62 -31.59 20.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.551 2.167 . . . . 0.0 113.981 -164.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.434 ' OD1' ' HG2' ' A' ' 20' ' ' LYS . 4.7 t70 -116.04 172.15 7.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.139 0.495 . . . . 0.0 111.551 -174.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -77.95 -25.45 48.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.993 -178.827 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.3 mmtm -71.24 -16.29 62.49 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.485 0.66 . . . . 0.0 110.005 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 1.023 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 1.2 m -97.2 -85.81 0.35 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.55 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.01 14.24 67.86 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.177 -0.919 . . . . 0.0 113.65 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.765 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 1.7 t30 -80.23 153.65 28.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.939 0.399 . . . . 0.0 111.219 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.432 ' H ' HG21 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -93.33 106.71 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.512 . . . . 0.0 110.07 174.268 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.576 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -87.95 176.36 7.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.029 -174.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -61.89 -89.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.401 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -65.14 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 3.0 mmt-85 -78.66 56.46 1.85 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.173 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.8 mmt-85 -126.43 129.93 49.7 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.599 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.71 -3.21 42.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.488 0.661 . . . . 0.0 109.864 172.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -130.98 166.41 21.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.491 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.618 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 85.2 m -56.9 169.48 0.51 Allowed 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.97 0.891 . . . . 0.0 113.176 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.576 ' HB2' ' HA ' ' A' ' 26' ' ' ASN . 3.2 t70 -99.68 -41.35 7.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.44 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.514 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -105.78 -48.01 3.74 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.357 -177.508 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.27 -43.26 42.51 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -171.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.618 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 90.84 37.7 6.32 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.322 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.508 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -100.63 170.45 8.36 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.012 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -91.26 149.47 21.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.445 ' HZ2' ' HG2' ' A' ' 40' ' ' LYS . 1.2 ttpp -57.28 102.32 0.09 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.118 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.524 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.932 177.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.022 0.439 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.584 ' HH2' HH12 ' A' ' 38' ' ' ARG . 13.5 p-90 -130.36 171.56 12.81 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -112.16 -101.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.417 -176.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' NH2' ' A' ' 38' ' ' ARG . 6.5 t -146.1 148.2 34.43 Favored Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.481 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.0 Cg_exo -62.03 -28.08 80.04 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.113 1.875 . . . . 0.0 111.981 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.73 176.94 7.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.661 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 -14.16 12.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.137 -176.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -26.87 37.04 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.941 0.401 . . . . 0.0 110.171 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 23' ' ' GLY . 4.2 t -80.28 -78.44 0.17 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.02 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.417 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 68.25 23.78 74.83 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.943 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 8.9 t30 -65.91 135.47 54.81 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 122.161 0.184 . . . . 0.0 110.579 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -78.5 96.63 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.545 0.688 . . . . 0.0 109.811 176.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.778 HD22 ' HA ' ' A' ' 33' ' ' CYS . 5.3 m-80 -83.28 -174.46 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.126 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -76.64 -135.59 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.612 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -134.03 -50.46 0.82 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -87.56 13.4 10.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.907 175.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.96 125.79 29.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.023 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.89 -8.92 48.06 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.034 0.445 . . . . 0.0 110.507 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.2 149.33 50.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.808 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HA ' HD22 ' A' ' 26' ' ' ASN . 2.9 t -62.59 160.62 13.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.028 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -100.76 -26.15 13.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.78 -64.98 1.03 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.079 -176.172 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.708 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 21.5 p -80.58 -40.07 26.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.596 -176.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.569 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.48 7.95 47.57 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.679 -0.772 . . . . 0.0 114.153 169.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.708 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -79.32 169.69 17.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.294 0.547 . . . . 0.0 110.941 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -90.05 155.84 18.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.89 0.376 . . . . 0.0 110.791 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -76.72 107.44 9.03 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.853 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.845 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 . . . . . 0 C--O 1.237 0.444 0 CA-C-O 121.243 0.544 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.443 ' CD2' ' HE2' ' A' ' 40' ' ' LYS . 12.1 p-90 -155.59 171.79 19.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.411 177.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.405 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -112.74 153.43 14.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 171.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.835 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 92.7 m -42.03 146.14 0.67 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.372 1.045 . . . . 0.0 112.516 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 31.4 Cg_exo -58.7 -28.04 85.21 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.94 2.427 . . . . 0.0 113.707 -172.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -121.24 177.17 5.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.162 0.506 . . . . 0.0 111.578 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.35 -27.43 19.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.185 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -70.32 -24.34 62.99 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.752 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -80.56 -82.43 0.12 Allowed 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.492 171.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.96 47.66 59.36 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.353 -0.84 . . . . 0.0 114.913 174.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.835 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 3.3 t30 -105.66 155.61 19.07 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 117.075 0.438 . . . . 0.0 110.847 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.3 OUTLIER -85.2 110.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.916 173.635 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -88.69 160.78 17.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.401 -177.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -51.72 -76.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.652 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.67 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.711 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.22 51.88 1.89 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.228 0.537 . . . . 0.0 110.381 179.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -108.31 128.49 54.79 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.419 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.97 7.22 43.15 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.963 0.411 . . . . 0.0 110.913 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.77 156.27 44.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.726 177.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 153.69 11.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 175.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.86 -7.93 23.07 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -169.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.89 -36.89 0.2 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -172.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.55 -29.4 3.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -160.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.72 -109.73 2.1 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.196 -1.002 . . . . 0.0 113.514 -170.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -171.19 -156.56 0.12 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.391 0.139 . . . . 0.0 110.979 -171.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.9 148.63 0.52 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.443 ' HE2' ' CD2' ' A' ' 15' ' ' TRP . 35.0 tttm -59.59 92.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.945 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.305 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.518 -0.254 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.577 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -161.07 164.18 30.97 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.983 0.421 . . . . 0.0 111.213 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pt -115.31 159.53 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 36.8 t -46.28 141.0 5.03 Favored Pre-proline 0 C--O 1.236 0.373 0 O-C-N 123.744 0.653 . . . . 0.0 111.669 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.577 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 7.6 Cg_exo -76.79 -10.56 18.37 Favored 'Trans proline' 0 N--CA 1.446 -1.299 0 C-N-CA 122.02 1.813 . . . . 0.0 111.435 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -106.46 160.64 15.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.653 -174.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -96.25 20.05 10.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.236 -176.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 -35.75 12.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.065 0.459 . . . . 0.0 109.8 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.1 m -99.28 -79.26 0.49 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.526 0.679 . . . . 0.0 111.475 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.73 21.72 76.23 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 -165.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.449 HD22 ' HB2' ' A' ' 34' ' ' ASP . 6.1 t30 -64.41 144.43 57.17 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 113.507 -1.347 . . . . 0.0 110.525 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.64 99.14 8.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.375 0.607 . . . . 0.0 109.8 174.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.534 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 3.5 m120 -78.7 163.2 25.62 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.816 -176.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.28 -85.24 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.556 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . 179.98 -58.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.424 ' HA ' ' HD2' ' A' ' 29' ' ' ARG . 7.4 mmm180 -78.11 31.74 0.18 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.62 175.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.45 ' H ' ' C ' ' A' ' 28' ' ' ALA . 63.6 mmt-85 -98.53 121.35 40.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.225 -176.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.69 -5.55 51.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.118 0.485 . . . . 0.0 110.435 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.1 m -142.82 168.1 20.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.331 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.767 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 17.2 t -63.06 156.93 23.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.593 0.711 . . . . 0.0 111.585 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.449 ' HB2' HD22 ' A' ' 24' ' ' ASN . 3.8 m-20 -96.11 -9.78 29.91 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.142 176.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -110.89 -59.85 1.91 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.829 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.0 p -94.52 -55.12 3.26 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.192 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.767 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.71 9.03 4.08 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.505 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 149.78 47.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.927 0.364 . . . . 0.0 110.439 177.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.43 155.74 37.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.615 0.245 . . . . 0.0 111.003 -175.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HG3' ' CE2' ' A' ' 15' ' ' TRP . 17.4 tttm -64.17 90.39 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.501 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.338 -176.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.509 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 6.4 p-90 -145.66 153.84 41.45 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.8 -80.02 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.719 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 4.6 m -149.92 151.67 32.75 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.647 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.509 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 10.0 Cg_exo -75.18 -17.9 18.78 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.82 2.347 . . . . 0.0 112.433 -175.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.488 ' CG ' ' HZ1' ' A' ' 21' ' ' LYS . 42.5 t0 -122.82 162.63 21.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.95 -170.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -15.97 32.76 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 175.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.488 ' HZ1' ' CG ' ' A' ' 19' ' ' ASP . 2.2 mttp -90.55 6.58 43.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.668 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.719 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -98.24 -89.53 0.3 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.05 179.099 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 72.38 55.7 6.69 Favored Glycine 0 CA--C 1.521 0.451 0 CA-C-N 115.18 -0.918 . . . . 0.0 114.35 173.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.6 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 18.6 t30 -123.79 167.64 13.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 173.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.0 104.63 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.965 0.412 . . . . 0.0 110.142 176.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -102.05 178.6 4.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.117 0.484 . . . . 0.0 111.628 -174.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -100.88 135.77 41.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.106 177.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.494 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -47.05 -51.59 17.09 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.213 0.605 . . . . 0.0 112.605 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 29' ' ' ARG . 4.1 ptt180 -69.74 -16.13 63.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.541 -177.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.2 mmt180 -74.36 133.98 42.49 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.8 2.22 40.95 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.933 0.397 . . . . 0.0 110.651 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -133.76 150.16 51.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.351 -178.696 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.495 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 34.0 m -70.04 145.48 51.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.927 175.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -83.97 -45.37 13.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.642 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 9.2 mmt180 -91.73 -48.46 6.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.049 0.452 . . . . 0.0 111.498 -174.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -45.36 24.67 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.203 -173.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.59 23.01 14.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.798 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.495 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -96.0 -164.04 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.643 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.479 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.0 mp0 -125.26 158.48 33.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -72.47 74.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.106 0.479 . . . . 0.0 110.869 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.319 -0.731 0 CA-C-O 121.289 0.566 . . . . 0.0 110.362 179.316 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.134 0.492 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.523 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 24.1 p-90 -160.09 153.94 22.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.325 173.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.08 156.48 8.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . 3.7 t -43.85 143.72 1.64 Allowed Pre-proline 0 C--O 1.235 0.329 0 O-C-N 123.778 0.674 . . . . 0.0 111.124 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.523 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.6 Cg_exo -63.55 -20.44 69.53 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.376 2.051 . . . . 0.0 112.278 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -111.65 149.58 31.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.449 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.22 -1.74 50.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.392 -174.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -76.29 -15.29 60.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.402 0.62 . . . . 0.0 110.053 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.752 ' HB2' HH21 ' A' ' 38' ' ' ARG . 0.1 OUTLIER -110.3 -82.39 0.57 Allowed 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.705 178.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.75 17.68 80.06 Favored Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.294 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.854 ' HB2' ' HD3' ' A' ' 35' ' ' ARG . 14.9 t30 -62.59 134.7 56.75 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -80.05 90.24 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.674 0.75 . . . . 0.0 110.363 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -79.61 112.93 17.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.917 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -19.52 -79.5 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.102 1.501 . . . . 0.0 113.997 -175.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -176.5 -64.73 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.08 41.35 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.519 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.6 mmt-85 -108.82 104.89 14.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.575 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.92 -10.91 59.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.271 0.557 . . . . 0.0 111.187 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -141.38 146.71 36.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.731 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 31.0 t -56.99 145.66 29.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.008 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -89.11 -15.96 32.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.175 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.854 ' HD3' ' HB2' ' A' ' 24' ' ' ASN . 3.6 ttp180 -95.15 -44.01 7.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.417 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.581 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 15.3 p -127.31 -26.31 3.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.731 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 100.25 14.38 33.36 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.555 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.752 HH21 ' HB2' ' A' ' 22' ' ' CYS . 2.9 tpp180 -60.92 143.81 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.862 0.363 . . . . 0.0 110.693 176.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.44 155.71 39.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -72.59 67.3 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.975 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.785 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 . . . . . 0 C--O 1.236 0.361 0 CA-C-O 120.845 0.355 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.501 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 1.1 p-90 -133.35 -167.06 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.266 -170.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.6 OUTLIER -122.36 -60.17 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 47.6 t -177.9 155.31 1.03 Allowed Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.617 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 23.1 Cg_exo -66.28 -13.48 40.04 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.967 1.778 . . . . 0.0 111.902 172.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -101.68 -173.61 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.794 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HZ1' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -129.38 -6.56 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.628 179.348 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -93.47 2.9 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.221 0.534 . . . . 0.0 110.012 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.454 ' HA ' HH21 ' A' ' 35' ' ' ARG . 5.8 t -104.21 -81.62 0.52 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.355 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.443 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.87 50.77 17.38 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.497 -0.858 . . . . 0.0 110.978 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.507 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 25.0 t30 -81.08 177.3 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.28 -0.46 . . . . 0.0 109.837 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.49 91.38 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.221 0.534 . . . . 0.0 110.204 175.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.729 HD21 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.78 151.97 25.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.284 0.564 . . . . 0.0 110.568 -179.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 1.9 t80 -81.64 148.03 29.25 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.134 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -43.26 -42.52 4.42 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.844 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -78.28 2.84 17.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.854 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.8 mmm180 -97.3 118.3 33.45 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 175.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -5.67 59.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.612 -177.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -140.62 159.94 41.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.478 -178.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.729 ' HA ' HD21 ' A' ' 26' ' ' ASN . 53.2 t -60.74 144.24 52.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.971 0.415 . . . . 0.0 109.901 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.406 ' HB2' HD22 ' A' ' 24' ' ' ASN . 0.2 OUTLIER -84.82 -8.42 58.81 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.454 HH21 ' HA ' ' A' ' 22' ' ' CYS . 0.3 OUTLIER -106.67 -52.84 2.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.171 178.801 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 86.1 m -78.73 -39.24 36.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.674 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.68 9.98 85.74 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.625 -0.797 . . . . 0.0 111.55 -175.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -88.94 143.12 27.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -70.66 156.2 39.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.377 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.39 110.16 1.36 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.711 173.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.235 0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.679 ' CZ3' ' HG3' ' A' ' 40' ' ' LYS . 50.9 p-90 -107.85 165.87 11.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.463 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.527 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.1 pp -106.32 150.48 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.762 175.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.86 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 56.7 m -41.09 150.42 0.31 Allowed Pre-proline 0 CA--C 1.537 0.447 0 O-C-N 124.45 1.094 . . . . 0.0 113.314 -177.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.937 ' HG3' ' HA ' ' A' ' 40' ' ' LYS . 34.3 Cg_exo -59.25 -31.12 94.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 123.368 2.712 . . . . 0.0 113.822 -174.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -114.91 167.88 10.4 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.015 0.436 . . . . 0.0 111.462 -173.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.85 -36.42 49.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.485 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -30.23 71.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.685 175.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.86 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -76.94 -83.72 0.07 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.852 177.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.463 ' N ' ' HB2' ' A' ' 17' ' ' CYS . . . 51.75 40.22 48.43 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.2 -0.909 . . . . 0.0 114.559 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.843 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 5.3 t30 -100.47 158.22 16.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 117.218 0.509 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.25 120.82 37.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.239 0.542 . . . . 0.0 110.579 177.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.31 177.47 4.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.545 -177.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.796 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 19.6 t80 -62.67 -93.38 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.702 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -163.42 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.48 42.22 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.519 0.676 . . . . 0.0 110.591 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.796 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -92.11 138.99 31.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.761 177.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -31.7 18.55 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.728 0.299 . . . . 0.0 110.845 177.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.733 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -114.74 159.15 20.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.085 0.469 . . . . 0.0 112.07 -175.365 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -59.63 159.08 8.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.022 175.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.39 -21.54 17.12 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.876 -170.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -142.71 -30.73 0.53 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.35 -16.34 2.75 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -158.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' SG ' ' A' ' 33' ' ' CYS . . . -139.96 -112.61 1.01 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 119.28 -1.438 . . . . 0.0 114.596 -172.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HB3' ' H ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -159.95 -160.03 0.77 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.669 -0.265 . . . . 0.0 110.61 -167.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.733 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.7 mt-10 -64.51 149.5 48.52 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.937 ' HA ' ' HG3' ' A' ' 18' ' ' PRO . 1.7 tttm -65.49 107.46 1.69 Allowed 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.795 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.447 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 2.8 p . . . . . 0 C--N 1.318 -0.794 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.125 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.368 0.604 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.518 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p-90 -151.02 167.4 27.76 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -122.1 148.65 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 24' ' ' ASN . 4.0 m -39.61 141.67 0.7 Allowed Pre-proline 0 C--O 1.239 0.543 0 O-C-N 124.27 0.981 . . . . 0.0 113.095 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 31.2 Cg_exo -61.21 -25.04 80.15 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.426 2.084 . . . . 0.0 111.818 -176.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.465 ' OD2' ' HB3' ' A' ' 21' ' ' LYS . 12.2 t70 -112.47 123.67 50.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.827 178.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.04 11.45 2.73 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -170.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -76.51 -30.05 57.04 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.28 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.755 ' HA ' HH21 ' A' ' 35' ' ' ARG . 53.2 t -96.31 -70.03 0.73 Allowed 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.11 52.07 53.59 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.469 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 t30 -87.41 150.7 23.62 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.094 -177.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.88 88.08 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.183 0.516 . . . . 0.0 110.112 177.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.865 HD21 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.25 118.45 21.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.628 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -18.63 -82.49 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 O-C-N 125.13 1.518 . . . . 0.0 113.918 -170.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.45 -50.26 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.28 23.63 2.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.632 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' ' 32' ' ' SER . 0.6 OUTLIER -96.58 115.54 27.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.446 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.94 -1.35 52.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 175.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.466 ' O ' ' HB3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -145.42 163.98 32.94 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.551 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.961 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 25.2 t -64.58 167.97 6.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.81 0.814 . . . . 0.0 112.018 175.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.0 -4.87 26.67 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.547 170.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.755 HH21 ' HA ' ' A' ' 22' ' ' CYS . 1.0 OUTLIER -123.95 -66.72 0.97 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.871 -177.434 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.505 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 25.9 p -80.0 -23.49 41.51 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.064 0.459 . . . . 0.0 110.636 -175.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.961 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 78.0 7.56 87.53 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.406 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.505 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -66.58 140.01 57.93 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.85 143.2 32.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.262 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -63.32 96.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.701 -178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.772 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.642 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.234 0.283 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.5 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 14.1 p-90 -152.09 154.18 35.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.096 0.474 . . . . 0.0 111.134 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -109.96 160.71 8.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.457 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 9.2 t -45.99 144.24 3.0 Favored Pre-proline 0 N--CA 1.463 0.192 0 O-C-N 123.809 0.693 . . . . 0.0 111.12 -178.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.5 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 18.9 Cg_exo -66.56 -2.63 7.71 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.41 2.074 . . . . 0.0 112.464 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -112.33 163.98 13.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.977 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.81 -21.39 16.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.993 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -68.86 -29.53 67.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.361 0.6 . . . . 0.0 110.007 177.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.45 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -90.18 -83.01 0.26 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.102 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.428 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.21 35.28 64.03 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -175.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -67.43 144.29 55.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.325 -0.437 . . . . 0.0 110.136 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.83 87.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.602 0.715 . . . . 0.0 111.021 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.432 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -79.82 118.54 21.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.463 178.271 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -34.81 -75.13 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 124.125 0.891 . . . . 0.0 112.697 -177.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 176.69 -47.67 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -174.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.722 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -88.88 77.09 7.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 175.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 30' ' ' ARG . 2.0 mmt85 -151.79 117.88 5.55 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.13 -1.395 . . . . 0.0 108.688 -176.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -96.33 -7.41 35.33 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.276 0.56 . . . . 0.0 110.667 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -147.41 173.03 13.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.503 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 8.0 t -65.82 154.43 39.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.278 0.561 . . . . 0.0 111.564 176.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.53 -9.34 22.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.172 173.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -101.0 -69.4 0.78 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.077 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 28.5 p -91.21 -34.88 14.81 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.059 -174.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.736 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 105.39 7.25 37.66 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.28 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.445 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -57.95 140.53 51.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.027 0.441 . . . . 0.0 110.711 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.0 pm0 -72.75 171.11 13.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.844 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -76.33 58.92 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.242 0.544 . . . . 0.0 109.898 176.544 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.287 -177.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.229 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.532 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 29.2 p-90 -160.39 157.26 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.624 0.25 . . . . 0.0 110.716 -176.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.8 pt -102.23 158.26 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 5.8 t -45.68 144.21 2.72 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 123.554 0.534 . . . . 0.0 111.806 -177.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.532 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 12.5 Cg_exo -72.67 1.52 6.24 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.023 2.482 . . . . 0.0 112.297 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.87 160.16 33.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.663 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -89.28 -19.93 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.831 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.674 ' HB2' HH22 ' A' ' 38' ' ' ARG . 31.3 mttt -62.42 -22.53 66.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.132 0.491 . . . . 0.0 110.874 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.411 ' HB3' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -101.91 -86.35 0.42 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.427 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 79.4 26.3 57.45 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.371 -174.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 7.8 t30 -80.02 134.86 36.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.591 -0.305 . . . . 0.0 110.924 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.66 114.78 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.976 0.417 . . . . 0.0 109.885 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.42 158.11 17.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.487 ' O ' ' HB3' ' A' ' 14' ' ' ASP . 35.2 t80 -53.3 -77.7 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 O-C-N 123.572 0.545 . . . . 0.0 112.055 -175.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.513 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -178.34 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.122 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.418 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -71.39 24.37 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.774 177.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 28' ' ' ALA . 11.7 mmt-85 -90.51 122.55 33.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.174 -177.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 -17.52 24.39 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.355 0.598 . . . . 0.0 109.631 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 50.8 m -132.35 168.41 18.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.397 174.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.412 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -64.0 164.51 10.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.937 0.875 . . . . 0.0 113.112 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -101.0 -24.69 14.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.213 170.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.58 -58.38 2.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.509 -171.292 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 31.2 p -93.65 -57.16 2.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.948 0.404 . . . . 0.0 110.753 -175.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.94 0.28 6.55 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.739 -178.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.674 HH22 ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.97 142.57 55.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.471 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.0 pm0 -87.63 172.87 9.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.416 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.66 67.86 0.8 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.858 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.635 -175.578 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.678 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 7.9 t70 . . . . . 0 CA--C 1.515 -0.367 0 CA-C-O 121.635 0.731 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.492 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 7.5 p-90 -160.16 161.24 33.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.743 -178.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -108.41 -75.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.781 177.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.84 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 1.5 m -147.53 152.67 42.35 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.596 ' HD2' ' SG ' ' A' ' 22' ' ' CYS . 17.4 Cg_exo -68.87 -30.01 27.36 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.036 2.491 . . . . 0.0 113.425 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -127.9 -175.2 3.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.054 0.454 . . . . 0.0 111.867 -173.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -93.13 -29.92 15.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.841 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -4.06 33.85 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.742 174.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.84 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -88.38 -85.33 0.19 Allowed 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.752 175.828 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.65 75.36 Favored Glycine 0 CA--C 1.518 0.253 0 CA-C-N 114.761 -1.109 . . . . 0.0 114.256 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.726 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 17.4 t30 -92.41 158.03 16.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.06 94.46 4.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.482 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -93.18 164.42 13.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.928 0.394 . . . . 0.0 110.613 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.425 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 t80 -83.91 -92.58 0.08 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.469 -173.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.678 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . . . -166.09 -62.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.247 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -81.01 21.61 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.221 0.534 . . . . 0.0 110.599 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 6.0 mtp85 -90.89 114.7 27.22 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.92 -0.67 57.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.264 0.554 . . . . 0.0 110.634 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -146.15 153.75 41.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.118 177.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.476 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 88.4 m -59.13 143.43 48.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.598 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -75.1 -37.66 61.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.995 176.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.21 -56.06 2.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.383 -175.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.419 ' HB2' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.46 -21.03 49.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.472 -173.505 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.424 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . 71.62 19.98 78.22 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.336 -0.459 . . . . 0.0 113.257 175.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.476 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 2.2 mmp_? -77.62 179.14 6.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.716 0.258 . . . . 0.0 110.538 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -103.85 151.56 22.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.078 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -69.17 89.7 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 110.415 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.151 178.408 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 CA--C 1.52 -0.2 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.474 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -130.24 165.34 22.62 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.764 -171.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -110.17 156.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 1.006 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 23.1 m -46.17 146.8 2.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 O-C-N 123.951 0.782 . . . . 0.0 112.999 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.474 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -69.13 -18.43 39.96 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.987 2.458 . . . . 0.0 113.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -123.85 171.46 9.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.124 0.488 . . . . 0.0 111.641 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.91 -24.92 22.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.296 177.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -78.63 -12.0 60.0 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.251 173.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 1.006 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -87.45 -83.6 0.2 Allowed 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.546 174.072 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.99 36.41 90.2 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.766 171.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.815 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 6.4 t30 -104.78 159.28 15.91 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 117.333 0.566 . . . . 0.0 110.317 175.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.46 117.48 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 175.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.42 HD21 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -114.87 173.93 6.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.321 0.581 . . . . 0.0 111.456 -171.91 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -101.24 139.11 37.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.25 -179.834 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.25 -37.66 24.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.85 174.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.2 mtt-85 -84.09 18.22 2.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.919 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 0.8 OUTLIER -121.36 114.64 21.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.776 178.775 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.15 -9.58 59.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.089 0.471 . . . . 0.0 110.955 177.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.576 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -136.45 153.67 50.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 176.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HA ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -60.53 174.65 0.54 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.144 0.973 . . . . 0.0 113.53 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -100.16 -26.12 14.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.745 -1.571 . . . . 0.0 110.049 177.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 35' ' ' ARG . 3.9 tpp180 -103.33 -65.41 1.01 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.528 -176.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -40.64 38.21 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.981 0.42 . . . . 0.0 111.75 -175.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.28 49.02 4.35 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.365 176.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.576 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.9 OUTLIER -105.68 153.83 21.29 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.288 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.32 140.7 29.83 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.44 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.7 tttm -67.39 100.78 0.87 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.721 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.358 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 3.3 p30 . . . . . 0 C--O 1.235 0.323 0 CA-C-O 120.965 0.412 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.521 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 32.7 p-90 -160.98 150.94 17.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.476 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.0 OUTLIER -102.3 157.53 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -43.15 140.54 2.02 Favored Pre-proline 0 C--O 1.236 0.353 0 O-C-N 123.886 0.741 . . . . 0.0 111.189 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.521 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 50.4 Cg_exo -56.26 -31.43 84.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.813 2.342 . . . . 0.0 112.661 -172.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.58 121.25 42.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttp -81.97 35.91 0.44 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -169.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -84.44 -14.16 50.07 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 165.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 t -108.12 -74.96 0.64 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.016 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 29.36 62.78 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.818 177.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.476 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 17.7 t30 -64.43 128.41 35.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.19 99.02 3.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.193 0.52 . . . . 0.0 109.748 178.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -84.26 147.11 27.42 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.5 -176.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -37.02 -73.46 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.57 1.169 . . . . 0.0 112.568 -175.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 178.47 -59.32 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.414 0.626 . . . . 0.0 109.71 178.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 29' ' ' ARG . 1.2 mmt180 -91.28 11.35 23.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.528 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.566 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -68.09 115.34 7.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.111 174.187 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.59 -21.64 35.11 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.832 0.349 . . . . 0.0 110.868 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.566 ' O ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -127.05 148.7 50.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.214 178.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.67 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 52.2 t -57.1 138.16 54.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.092 0.472 . . . . 0.0 110.913 178.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.15 -20.98 60.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.078 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 35' ' ' ARG . 1.9 mtm-85 -91.92 -55.22 3.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.279 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.5 m -85.65 -59.61 2.26 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.716 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.67 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.19 -3.19 28.31 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.26 140.82 58.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.63 148.36 30.29 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.617 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -55.03 99.99 0.03 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.223 0.535 . . . . 0.0 110.966 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.589 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.11 159.66 31.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.637 0.256 . . . . 0.0 111.381 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.64 83.71 0.15 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.254 178.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.71 103.2 0.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.807 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.15 130.91 53.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.15 -29.41 60.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.447 0.641 . . . . 0.0 109.596 175.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -93.17 165.03 13.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.283 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.463 ' HD2' HG12 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -89.64 -165.84 1.45 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.357 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.1 mmt-85 -91.59 49.43 1.58 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.536 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.463 HG12 ' HD2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -156.31 161.64 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.622 -174.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.74 -160.53 0.8 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.878 0.371 . . . . 0.0 111.455 -177.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.21 -51.43 17.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.838 -176.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.93 -45.46 10.47 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.853 -174.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.79 143.36 44.04 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.526 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 20.3 p-90 -130.88 170.53 14.3 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.7 0.286 . . . . 0.0 111.206 -174.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.504 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.1 pt -121.44 155.45 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.174 175.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -41.85 142.78 1.05 Allowed Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 124.022 0.826 . . . . 0.0 111.984 -179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.526 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.3 Cg_exo -61.72 -21.25 71.71 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.653 2.236 . . . . 0.0 112.048 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -103.8 149.43 25.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.903 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.37 -6.17 57.86 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.319 -173.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -65.74 -41.46 92.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.439 0.638 . . . . 0.0 109.733 175.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.42 -79.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.357 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.14 30.01 70.03 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 6.8 t30 -63.25 139.1 58.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.484 -0.358 . . . . 0.0 110.322 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 25' ' ' VAL . 1.4 m -78.96 102.33 4.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.406 0.622 . . . . 0.0 109.334 173.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.682 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 5.7 m120 -79.03 156.0 28.58 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.374 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.506 ' HB3' ' HG2' ' A' ' 30' ' ' ARG . 59.0 t80 -45.41 -82.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.03 0.831 . . . . 0.0 111.365 178.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 178.39 -66.65 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.97 53.72 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.768 173.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.506 ' HG2' ' HB3' ' A' ' 27' ' ' PHE . 55.0 mmt-85 -111.48 112.33 23.98 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.924 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -8.08 57.72 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.228 0.537 . . . . 0.0 109.722 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 1.5 m -140.56 152.41 45.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.509 174.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.753 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.6 t -53.63 152.7 4.92 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.494 0.664 . . . . 0.0 111.657 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.04 -18.93 32.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.355 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.31 -52.06 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.151 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.409 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 58.0 m -79.41 -53.86 6.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.39 0.614 . . . . 0.0 111.508 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.753 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 94.08 13.83 53.41 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -167.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.429 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.2 OUTLIER -81.28 145.14 31.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.219 -0.491 . . . . 0.0 109.877 178.071 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -69.83 143.99 52.72 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -171.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -59.19 107.22 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.042 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.9 169.4 15.25 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -177.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.26 -63.02 1.17 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.874 177.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.43 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . 86.71 142.11 6.92 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.899 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.43 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 2.9 Cg_exo -76.43 -178.06 4.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.995 2.464 . . . . 0.0 111.507 176.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.0 mm . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.24 179.785 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.778 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m 53.91 54.0 10.41 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.813 0.445 . . . . 0.0 112.182 176.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -67.16 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 172.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.77 -42.85 17.45 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.42 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER 62.66 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.105 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.42 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -101.02 153.28 19.68 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -177.732 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -70.59 120.54 16.36 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -74.53 109.47 8.04 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 121.62 0.724 . . . . 0.0 110.815 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.49 137.12 36.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.445 173.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -65.46 132.57 31.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.742 0.306 . . . . 0.0 110.344 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.92 176.53 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.199 -177.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.86 -39.65 93.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.513 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -90.82 4.55 81.86 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.351 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -83.75 -172.82 4.36 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 109.926 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.611 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 3.3 p-90 -156.48 -166.8 2.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.4 -75.48 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.188 0.518 . . . . 0.0 109.87 175.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 44.7 t -142.97 155.24 62.51 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 174.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.611 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 17.9 Cg_exo -68.42 -14.2 39.41 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.983 1.789 . . . . 0.0 110.975 176.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.441 ' OD1' ' HG2' ' A' ' 21' ' ' LYS . 2.6 t0 -106.59 177.62 4.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.794 177.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.79 -10.94 9.44 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.838 0.352 . . . . 0.0 110.545 -179.075 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.441 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 9.0 pttm -85.21 -2.87 58.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.542 177.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 44.0 t -119.41 -86.76 0.64 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.568 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 59.64 4.61 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.809 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.481 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 48.7 t30 -76.21 159.97 30.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.663 0.268 . . . . 0.0 110.723 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.85 62.1 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.228 0.537 . . . . 0.0 110.865 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.42 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 78.7 m-20 -89.53 125.7 35.3 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.409 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -84.15 171.51 12.77 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.03 -51.78 16.54 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -70.1 -12.48 61.63 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.563 ' O ' ' HZ2' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -79.23 86.46 5.0 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.504 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -0.79 12.66 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -142.06 135.39 29.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.75 0.31 . . . . 0.0 111.559 -177.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HA ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 t -69.2 138.4 54.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.252 0.548 . . . . 0.0 109.886 174.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.441 ' HA ' HH21 ' A' ' 38' ' ' ARG . 0.8 OUTLIER -100.43 2.52 42.3 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.637 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.481 ' HB2' ' HB2' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -104.87 -58.88 1.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.317 -174.627 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 24.7 p -93.26 -61.24 1.61 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.192 0.52 . . . . 0.0 111.661 -171.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 36' ' ' CYS . . . -133.5 -86.0 0.27 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.879 -175.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.441 HH21 ' HA ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -175.73 -132.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.681 0.24 . . . . 0.0 111.188 -169.175 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.59 145.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.77 0.828 . . . . 0.0 113.187 -173.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -64.34 104.36 0.76 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.968 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.86 88.44 0.55 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.422 -179.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -135.66 101.86 4.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.027 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -132.11 68.32 0.55 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.963 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -89.68 -177.07 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.62 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.306 176.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 112.28 -0.328 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 112.94 25.03 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.703 0.287 . . . . 0.0 110.804 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -151.18 96.79 2.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.952 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m 58.1 39.02 26.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.694 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -133.02 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.424 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.57 155.11 18.04 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.761 0.315 . . . . 0.0 110.665 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.71 113.22 16.58 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.88 93.28 4.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.413 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.407 ' NE ' ' HA ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -78.52 105.46 9.8 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 172.046 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.95 95.12 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.028 -176.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -15.58 61.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.398 0.618 . . . . 0.0 111.045 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -81.08 -32.4 33.94 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.349 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 118.24 96.6 1.8 Allowed Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.428 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.53 146.39 31.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.136 0.493 . . . . 0.0 110.039 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.496 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 8.8 p-90 -136.96 177.91 7.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.944 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.791 ' HB ' ' HA2' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -111.88 -108.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.155 -176.675 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 4.1 t -134.89 137.62 27.7 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.496 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.4 Cg_exo -62.55 -26.69 76.16 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.725 2.283 . . . . 0.0 112.395 -171.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.529 ' HB3' ' HD3' ' A' ' 20' ' ' LYS . 6.8 t0 -147.1 178.03 8.7 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.557 ' HZ1' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER 72.46 150.66 0.1 Allowed 'General case' 0 N--CA 1.432 -1.333 0 CA-C-O 122.123 0.963 . . . . 0.0 110.345 175.821 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 39.01 0.16 Allowed 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.527 172.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.514 ' H ' ' C ' ' A' ' 20' ' ' LYS . 14.2 t -77.2 -78.6 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.112 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.791 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 70.54 36.93 68.56 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.767 178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 4.8 t30 -70.73 131.2 43.5 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -77.73 99.28 2.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.476 0.655 . . . . 0.0 110.53 -177.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -85.4 151.32 24.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.447 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -48.41 -80.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 O-C-N 123.816 0.697 . . . . 0.0 111.56 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -59.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.496 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 0.5 OUTLIER -83.52 52.28 2.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.873 178.748 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.57 ' NH2' ' HA ' ' A' ' 34' ' ' ASP . 0.1 OUTLIER -122.46 117.57 26.29 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.515 174.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -82.69 -3.72 56.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.931 0.396 . . . . 0.0 110.824 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 9.8 m -141.84 154.98 45.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.366 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.9 t -58.36 136.46 57.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.163 0.506 . . . . 0.0 110.693 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.57 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 12.3 t70 -72.63 -11.42 60.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.349 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -108.47 -57.77 2.09 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.989 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.8 m -79.14 -37.8 37.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 111.904 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 85.54 11.45 74.7 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -171.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 133.06 36.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.4 OUTLIER -77.07 158.53 30.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.37 -174.801 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.98 78.7 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.904 172.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.71 106.49 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.709 -173.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 120.73 14.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.307 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -147.5 -80.76 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.768 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.22 -36.87 77.97 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 122.533 2.155 . . . . 0.0 111.143 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.46 ' OXT' HG22 ' A' ' 45' ' ' ILE . 1.8 mm . . . . . 0 C--O 1.25 1.086 0 CA-C-O 117.76 -1.114 . . . . 0.0 108.594 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.535 -0.626 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.83 103.17 3.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 0.0 111.019 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.08 -12.2 16.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.827 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.18 91.1 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.933 0.397 . . . . 0.0 110.185 176.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.428 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -77.91 -106.91 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.188 179.442 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.428 ' H ' ' HB ' ' A' ' 5' ' ' THR . 4.2 mptt -100.8 48.65 0.9 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.067 0.46 . . . . 0.0 110.825 -176.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.65 121.45 17.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.771 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -81.12 59.18 3.77 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.867 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.559 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -81.51 70.28 8.34 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 172.842 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' A' ' 9' ' ' ARG . 5.4 t 78.25 133.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.919 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.34 156.12 26.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.954 -176.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -72.21 -48.84 39.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.709 -175.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.533 ' HA3' ' HB1' ' A' ' 28' ' ' ALA . . . -108.52 33.41 6.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.502 -172.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -64.87 152.86 41.9 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.523 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -129.74 -10.74 4.43 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.161 0.981 . . . . 0.0 109.904 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.545 HG22 ' N ' ' A' ' 17' ' ' CYS . 7.8 mm 71.11 138.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.444 0 CA-C-N 112.751 -2.022 . . . . 0.0 109.642 -172.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.545 ' N ' HG22 ' A' ' 16' ' ' ILE . 24.7 t -42.66 146.44 0.73 Allowed Pre-proline 0 C--O 1.24 0.561 0 C-N-CA 122.832 0.453 . . . . 0.0 111.999 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.523 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -68.31 -13.78 38.62 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.42 2.08 . . . . 0.0 111.379 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -98.18 -178.72 4.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.948 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.1 11.48 11.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.014 0.435 . . . . 0.0 110.567 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -97.97 -24.07 15.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.779 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' HB3' ' A' ' 35' ' ' ARG . 59.5 m -97.06 -73.11 0.62 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.409 0.623 . . . . 0.0 111.454 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.52 37.17 78.06 Favored Glycine 0 N--CA 1.44 -1.047 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 -166.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.96 137.77 58.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.534 -0.833 . . . . 0.0 111.568 -176.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -86.62 87.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.018 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.7 166.76 21.48 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.715 -173.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -65.27 -74.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.533 ' HB1' ' HA3' ' A' ' 13' ' ' GLY . . . -179.09 -76.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.079 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.431 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 37.1 mmt-85 -77.45 42.79 0.36 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.067 -178.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.41 ' H ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -96.86 135.19 39.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 174.327 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 1.38 51.7 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.0 0.429 . . . . 0.0 110.504 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.98 155.63 41.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.591 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.458 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 40.7 t -67.78 155.1 40.07 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.5 176.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -17.57 17.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.373 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.64 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -88.19 -45.64 9.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.938 -178.323 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -113.45 -55.75 2.48 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.956 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.458 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 125.74 8.92 5.05 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.09 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -62.21 137.5 58.27 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -75.68 153.68 36.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.357 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -58.6 107.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.638 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -63.17 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.013 0.435 . . . . 0.0 111.482 -176.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.96 -42.76 0.27 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.3 0.571 . . . . 0.0 110.673 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 137.83 -71.85 0.45 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.07 -28.02 41.65 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.157 1.905 . . . . 0.0 110.465 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.881 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.342 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 112.184 -0.367 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.77 42.9 30.27 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.966 0.412 . . . . 0.0 111.794 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.08 -80.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.164 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m 54.86 -100.67 0.11 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.694 -176.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -111.99 1.9 16.64 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.197 0.522 . . . . 0.0 111.062 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.86 69.41 1.34 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.499 . . . . 0.0 110.506 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 149.59 22.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.178 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 11.1 t80 59.55 77.45 0.31 Allowed 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.789 0.681 . . . . 0.0 111.865 176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.581 HH22 ' HE1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -93.29 127.3 38.82 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -130.99 128.39 62.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.495 ' O ' ' HB2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -75.66 143.23 42.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.305 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.41 148.27 37.42 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.557 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 91.23 -11.98 70.54 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.306 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.495 ' HB2' ' O ' ' A' ' 11' ' ' SER . 14.6 m-20 -71.32 161.79 30.5 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.514 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 23.5 p-90 -125.03 133.27 53.02 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.44 ' HB ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -69.7 -55.51 14.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.703 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 3.6 m -162.55 168.07 11.21 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.514 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 23.1 Cg_exo -64.74 -35.05 47.99 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.935 1.757 . . . . 0.0 111.19 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.699 ' HB3' ' HG2' ' A' ' 21' ' ' LYS . 29.8 t0 -155.17 163.4 40.25 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.116 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 31.78 0.16 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.937 0.399 . . . . 0.0 111.249 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.699 ' HG2' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -79.12 -38.98 34.8 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 173.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.65 -91.25 0.28 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.632 0.729 . . . . 0.0 109.408 170.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.48 64.69 0.45 Allowed Glycine 0 C--N 1.314 -0.685 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.717 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.452 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 51.4 t30 -105.8 -173.22 2.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.49 90.31 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.198 0.523 . . . . 0.0 109.676 174.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -95.3 167.49 11.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.519 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.661 ' HD2' ' HG2' ' A' ' 29' ' ' ARG . 3.9 t80 -102.22 144.05 31.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.955 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.483 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -51.11 -34.02 28.81 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.661 ' HG2' ' HD2' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -80.51 -3.84 51.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.944 0.402 . . . . 0.0 110.837 -179.208 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 15.9 mtt-85 -80.42 129.28 34.41 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.13 -12.73 40.24 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.295 0.569 . . . . 0.0 110.646 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.16 158.19 43.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.677 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.451 ' SG ' ' HD3' ' A' ' 18' ' ' PRO . 64.6 m -54.82 136.11 47.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.821 171.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.93 -41.9 18.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.894 0.378 . . . . 0.0 111.71 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -42.79 8.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.087 0.47 . . . . 0.0 110.745 -174.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.448 ' SG ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.94 -57.45 3.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.854 -176.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 111.31 19.94 7.29 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.487 -0.863 . . . . 0.0 114.638 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.44 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -91.91 167.37 12.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.853 0.827 . . . . 0.0 109.089 173.049 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pm0 -96.39 151.86 19.14 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 121.93 -0.482 . . . . 0.0 110.624 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.4 68.9 2.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.149 0.5 . . . . 0.0 110.071 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -72.94 -30.63 64.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.767 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.48 107.0 4.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.347 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -137.19 -167.81 11.19 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -75.74 60.35 5.94 Favored 'Trans proline' 0 CA--C 1.53 0.285 0 C-N-CA 123.155 2.57 . . . . 0.0 112.162 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.6 mt . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.517 179.26 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 111.936 -0.466 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.19 86.92 1.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.131 0.491 . . . . 0.0 110.682 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.55 13.91 17.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.04 12.93 14.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.925 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.7 m 68.68 104.37 0.05 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.515 -175.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 115.13 2.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.876 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.08 164.1 16.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.239 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -65.73 92.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.234 0.54 . . . . 0.0 110.945 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.05 133.35 35.38 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.851 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.41 171.02 3.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.111 179.343 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.43 142.09 58.05 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.11 157.26 16.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.592 0.711 . . . . 0.0 111.172 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 98.95 -43.83 1.8 Allowed Glycine 0 C--N 1.314 -0.693 0 N-CA-C 110.038 -1.225 . . . . 0.0 110.038 -168.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 136.52 33.14 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.692 ' HH2' HH12 ' A' ' 38' ' ' ARG . 6.6 p-90 -127.17 149.48 49.95 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.145 0.498 . . . . 0.0 110.903 -177.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.451 HG21 ' HA ' ' A' ' 25' ' ' VAL . 3.8 pt -98.8 -117.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.72 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 5.5 t -123.2 149.88 58.58 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 175.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 46.4 Cg_exo -57.18 -29.99 85.56 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.989 1.792 . . . . 0.0 112.444 -177.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.482 ' CG ' ' H ' ' A' ' 20' ' ' LYS . 18.7 t70 -110.97 -174.94 2.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.976 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 5.3 mtmm -103.27 -9.95 19.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.161 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -60.41 -37.8 82.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.112 0.482 . . . . 0.0 110.265 177.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.548 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -88.02 -79.74 0.29 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.509 0.671 . . . . 0.0 110.317 174.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.48 27.37 73.55 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -170.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -84.19 133.61 34.59 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.014 -0.593 . . . . 0.0 110.677 -176.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.451 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -78.16 92.29 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.482 0.658 . . . . 0.0 110.492 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 34' ' ' ASP . 91.4 m-20 -79.93 -172.88 3.6 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.413 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.757 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 2.2 t80 -73.75 -131.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.09 -62.99 0.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.95 41.61 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.241 175.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.757 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -111.01 121.48 45.47 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.459 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.69 21.3 8.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.604 0.716 . . . . 0.0 109.933 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.2 m -153.99 150.69 28.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.446 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.825 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -63.54 158.5 20.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.404 0.621 . . . . 0.0 111.8 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.516 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 0.5 OUTLIER -92.9 -18.75 22.4 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.391 174.607 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.548 ' NH2' ' HA ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -104.44 -68.26 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.678 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.701 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 29.5 p -79.91 -30.4 40.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.195 0.521 . . . . 0.0 110.259 -176.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.825 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 87.72 6.68 76.23 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.881 -0.676 . . . . 0.0 113.926 168.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.701 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -73.04 166.85 22.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.633 0.717 . . . . 0.0 110.051 177.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.466 ' O ' ' HD2' ' A' ' 38' ' ' ARG . 20.3 pm0 -74.25 175.69 7.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.515 -177.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -77.52 55.08 1.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.849 0.833 . . . . 0.0 110.555 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.55 117.51 25.37 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.393 178.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.26 20.0 12.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.466 0.65 . . . . 0.0 110.516 -179.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.402 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -82.16 143.31 22.89 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.967 176.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.402 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 21.0 Cg_exo -65.83 99.9 0.41 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.811 2.341 . . . . 0.0 112.191 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.244 0.792 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.79 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.413 ' O ' ' HB3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -63.85 118.38 8.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.427 0.113 . . . . 0.0 110.857 -178.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.413 ' HB3' ' O ' ' A' ' 2' ' ' SER . 3.4 tmm? 73.1 -52.69 0.71 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.955 0.785 . . . . 0.0 111.546 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.03 78.72 7.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.018 0.437 . . . . 0.0 111.254 -178.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.36 6.63 13.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.003 0.43 . . . . 0.0 111.332 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -86.35 65.14 8.92 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 172.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -100.4 -153.33 0.44 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.537 -173.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -87.64 120.26 28.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.941 -175.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 71.28 3.2 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.767 172.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -151.58 25.68 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.499 1.143 . . . . 0.0 108.709 -178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.447 ' HB2' ' H ' ' A' ' 12' ' ' ASP . 2.2 p -102.05 -139.06 0.34 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.599 -174.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.447 ' H ' ' HB2' ' A' ' 11' ' ' SER . 18.2 p-10 -83.95 154.55 23.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 170.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.16 -44.79 3.12 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -170.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.25 177.31 6.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.486 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 39.6 p-90 -160.98 148.43 15.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.705 0.288 . . . . 0.0 110.618 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.419 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -99.92 157.12 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 1.023 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 6.2 m -47.62 144.69 4.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 123.879 0.737 . . . . 0.0 111.916 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.524 ' HG2' ' H ' ' A' ' 41' ' ' THR . 11.8 Cg_exo -69.62 -31.59 20.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.551 2.167 . . . . 0.0 113.981 -164.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.434 ' OD1' ' HG2' ' A' ' 20' ' ' LYS . 4.7 t70 -116.04 172.15 7.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.139 0.495 . . . . 0.0 111.551 -174.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.434 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -77.95 -25.45 48.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.993 -178.827 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.3 mmtm -71.24 -16.29 62.49 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.485 0.66 . . . . 0.0 110.005 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 1.023 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 1.2 m -97.2 -85.81 0.35 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.55 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.01 14.24 67.86 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.177 -0.919 . . . . 0.0 113.65 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.765 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 1.7 t30 -80.23 153.65 28.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.939 0.399 . . . . 0.0 111.219 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.432 ' H ' HG21 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -93.33 106.71 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.512 . . . . 0.0 110.07 174.268 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.576 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -87.95 176.36 7.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.029 -174.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -61.89 -89.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.401 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -65.14 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 3.0 mmt-85 -78.66 56.46 1.85 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.173 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.8 mmt-85 -126.43 129.93 49.7 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.599 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.71 -3.21 42.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.488 0.661 . . . . 0.0 109.864 172.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -130.98 166.41 21.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.491 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.618 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 85.2 m -56.9 169.48 0.51 Allowed 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.97 0.891 . . . . 0.0 113.176 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.576 ' HB2' ' HA ' ' A' ' 26' ' ' ASN . 3.2 t70 -99.68 -41.35 7.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.44 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.514 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -105.78 -48.01 3.74 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.357 -177.508 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.27 -43.26 42.51 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -171.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.618 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 90.84 37.7 6.32 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.322 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.508 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -100.63 170.45 8.36 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.012 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -91.26 149.47 21.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.445 ' HZ2' ' HG2' ' A' ' 40' ' ' LYS . 1.2 ttpp -57.28 102.32 0.09 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.118 -179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.524 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -68.06 105.23 1.98 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.932 177.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.23 106.63 6.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.177 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 154.39 -74.01 0.24 Allowed Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.731 -176.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.98 138.69 37.68 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.933 2.422 . . . . 0.0 111.849 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.1 tp . . . . . 0 C--O 1.251 1.17 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.897 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 112.217 -0.353 . . . . 0.0 112.217 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.36 -45.48 62.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.657 0.265 . . . . 0.0 111.525 -178.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.65 -73.06 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.96 142.57 27.15 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.29 23.97 0.27 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -174.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -99.44 106.9 19.0 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -99.97 166.4 11.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.596 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -78.23 80.7 4.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.28 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -97.77 121.3 39.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.61 175.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.432 HG11 ' H ' ' A' ' 12' ' ' ASP . 10.9 t -62.5 128.7 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.961 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -13.14 58.1 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.419 0.628 . . . . 0.0 111.724 -176.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.432 ' H ' HG11 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -74.92 -19.92 59.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.31 177.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 112.96 -12.34 24.61 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.171 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -82.46 168.24 17.63 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.022 0.439 . . . . 0.0 111.171 -177.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.584 ' HH2' HH12 ' A' ' 38' ' ' ARG . 13.5 p-90 -130.36 171.56 12.81 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -112.16 -101.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.417 -176.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' NH2' ' A' ' 38' ' ' ARG . 6.5 t -146.1 148.2 34.43 Favored Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.481 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.0 Cg_exo -62.03 -28.08 80.04 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.113 1.875 . . . . 0.0 111.981 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.73 176.94 7.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.661 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 -14.16 12.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.137 -176.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -26.87 37.04 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.941 0.401 . . . . 0.0 110.171 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 23' ' ' GLY . 4.2 t -80.28 -78.44 0.17 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.02 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.417 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 68.25 23.78 74.83 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.943 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 8.9 t30 -65.91 135.47 54.81 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 122.161 0.184 . . . . 0.0 110.579 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -78.5 96.63 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.545 0.688 . . . . 0.0 109.811 176.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.778 HD22 ' HA ' ' A' ' 33' ' ' CYS . 5.3 m-80 -83.28 -174.46 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.126 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -76.64 -135.59 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.612 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -134.03 -50.46 0.82 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -87.56 13.4 10.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.907 175.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.96 125.79 29.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.023 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.89 -8.92 48.06 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.034 0.445 . . . . 0.0 110.507 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.2 149.33 50.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.808 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HA ' HD22 ' A' ' 26' ' ' ASN . 2.9 t -62.59 160.62 13.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.028 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -100.76 -26.15 13.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.78 -64.98 1.03 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.079 -176.172 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.708 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 21.5 p -80.58 -40.07 26.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.596 -176.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.569 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.48 7.95 47.57 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.679 -0.772 . . . . 0.0 114.153 169.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.708 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -79.32 169.69 17.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.294 0.547 . . . . 0.0 110.941 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -90.05 155.84 18.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.89 0.376 . . . . 0.0 110.791 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -76.72 107.44 9.03 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.853 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.18 -35.15 79.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.845 178.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 63.92 53.91 1.83 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.992 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -106.09 114.46 4.48 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.01 -33.52 19.23 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.348 2.032 . . . . 0.0 112.632 -177.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.454 -176.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.583 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 88.35 4.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.967 0.413 . . . . 0.0 110.706 178.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.91 -62.57 1.29 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.513 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.39 29.16 3.01 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.235 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.59 118.13 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.505 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.45 179.58 4.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.1 175.678 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -83.31 174.32 10.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 0.0 110.439 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -81.75 9.37 8.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.599 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.88 131.97 47.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.948 0.404 . . . . 0.0 110.059 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 t -80.77 132.7 31.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.087 0.47 . . . . 0.0 110.487 -176.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.58 154.69 19.79 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.629 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.56 141.01 29.2 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 87.86 23.43 38.73 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -171.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -94.45 -172.81 2.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.292 -0.954 . . . . 0.0 111.511 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.443 ' CD2' ' HE2' ' A' ' 40' ' ' LYS . 12.1 p-90 -155.59 171.79 19.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.411 177.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.405 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -112.74 153.43 14.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 171.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.835 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 92.7 m -42.03 146.14 0.67 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.372 1.045 . . . . 0.0 112.516 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.697 ' HA ' HG21 ' A' ' 42' ' ' THR . 31.4 Cg_exo -58.7 -28.04 85.21 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.94 2.427 . . . . 0.0 113.707 -172.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -121.24 177.17 5.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.162 0.506 . . . . 0.0 111.578 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.35 -27.43 19.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.185 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -70.32 -24.34 62.99 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.752 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -80.56 -82.43 0.12 Allowed 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.492 171.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.96 47.66 59.36 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.353 -0.84 . . . . 0.0 114.913 174.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.835 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 3.3 t30 -105.66 155.61 19.07 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 117.075 0.438 . . . . 0.0 110.847 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 25' ' ' VAL . 0.3 OUTLIER -85.2 110.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.916 173.635 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -88.69 160.78 17.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.401 -177.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -51.72 -76.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.652 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.67 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.711 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.22 51.88 1.89 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.228 0.537 . . . . 0.0 110.381 179.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -108.31 128.49 54.79 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.419 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.97 7.22 43.15 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.963 0.411 . . . . 0.0 110.913 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.77 156.27 44.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.726 177.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 153.69 11.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 175.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.86 -7.93 23.07 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -169.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.89 -36.89 0.2 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -172.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.55 -29.4 3.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -160.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.72 -109.73 2.1 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.196 -1.002 . . . . 0.0 113.514 -170.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -171.19 -156.56 0.12 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.391 0.139 . . . . 0.0 110.979 -171.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.9 148.63 0.52 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.443 ' HE2' ' CD2' ' A' ' 15' ' ' TRP . 35.0 tttm -59.59 92.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.945 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -5.21 59.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.305 -178.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.697 HG21 ' HA ' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -80.6 -11.6 59.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.0 178.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 89.43 -149.78 20.85 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.527 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -74.86 -155.16 0.04 OUTLIER 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.178 2.586 . . . . 0.0 112.024 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.8 mm . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.129 -0.939 . . . . 0.0 109.619 176.847 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.93 4.49 47.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.004 0.43 . . . . 0.0 111.243 -178.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.04 59.42 5.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.117 0.484 . . . . 0.0 110.802 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.62 -63.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.468 176.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.63 73.76 2.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.118 0.485 . . . . 0.0 110.636 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.91 21.21 14.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.384 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -80.84 -34.4 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.13 -175.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.3 109.11 20.97 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.711 -177.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.58 36.12 1.01 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.62 0.724 . . . . 0.0 109.465 176.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -143.24 168.28 12.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.723 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.8 -168.34 0.45 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -176.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.7 -55.98 5.98 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.301 -173.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -87.58 -6.52 76.98 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.111 -176.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.69 159.86 27.78 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.577 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -161.07 164.18 30.97 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.983 0.421 . . . . 0.0 111.213 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pt -115.31 159.53 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 36.8 t -46.28 141.0 5.03 Favored Pre-proline 0 C--O 1.236 0.373 0 O-C-N 123.744 0.653 . . . . 0.0 111.669 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.577 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 7.6 Cg_exo -76.79 -10.56 18.37 Favored 'Trans proline' 0 N--CA 1.446 -1.299 0 C-N-CA 122.02 1.813 . . . . 0.0 111.435 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -106.46 160.64 15.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.653 -174.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -96.25 20.05 10.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.236 -176.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 -35.75 12.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.065 0.459 . . . . 0.0 109.8 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.1 m -99.28 -79.26 0.49 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.526 0.679 . . . . 0.0 111.475 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.73 21.72 76.23 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 -165.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.449 HD22 ' HB2' ' A' ' 34' ' ' ASP . 6.1 t30 -64.41 144.43 57.17 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 113.507 -1.347 . . . . 0.0 110.525 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.64 99.14 8.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.375 0.607 . . . . 0.0 109.8 174.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.534 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 3.5 m120 -78.7 163.2 25.62 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.816 -176.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.28 -85.24 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.556 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . 179.98 -58.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.424 ' HA ' ' HD2' ' A' ' 29' ' ' ARG . 7.4 mmm180 -78.11 31.74 0.18 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.62 175.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.45 ' H ' ' C ' ' A' ' 28' ' ' ALA . 63.6 mmt-85 -98.53 121.35 40.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.225 -176.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.69 -5.55 51.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.118 0.485 . . . . 0.0 110.435 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.1 m -142.82 168.1 20.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.331 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.767 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 17.2 t -63.06 156.93 23.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.593 0.711 . . . . 0.0 111.585 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.449 ' HB2' HD22 ' A' ' 24' ' ' ASN . 3.8 m-20 -96.11 -9.78 29.91 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.142 176.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -110.89 -59.85 1.91 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.829 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.0 p -94.52 -55.12 3.26 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.192 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.767 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.71 9.03 4.08 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.505 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 149.78 47.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.927 0.364 . . . . 0.0 110.439 177.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.43 155.74 37.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.615 0.245 . . . . 0.0 111.003 -175.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.541 ' HG3' ' CE2' ' A' ' 15' ' ' TRP . 17.4 tttm -64.17 90.39 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.501 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.03 47.03 1.45 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.338 -176.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.417 ' OG1' ' HG2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -85.36 56.97 4.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.78 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -138.43 -103.97 0.62 Allowed Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -87.67 110.49 0.72 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.551 2.167 . . . . 0.0 111.42 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.301 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.2 70.92 10.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.053 0.454 . . . . 0.0 110.601 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.8 ttp -83.71 64.87 8.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 110.37 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.09 179.47 4.26 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.404 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 12.3 t -147.45 -166.2 2.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.01 68.41 10.05 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 177.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -51.34 112.65 0.78 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.426 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.48 178.98 2.69 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.552 0.691 . . . . 0.0 110.888 -176.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.79 45.11 1.12 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.137 -177.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.423 ' H ' HG23 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -120.28 12.55 6.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 178.708 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.08 50.47 1.09 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.439 0.638 . . . . 0.0 111.082 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.37 -143.57 0.06 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.008 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -86.44 10.89 65.17 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.68 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -95.01 -172.63 2.74 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.509 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 6.4 p-90 -145.66 153.84 41.45 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.8 -80.02 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.719 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 4.6 m -149.92 151.67 32.75 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.647 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.509 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 10.0 Cg_exo -75.18 -17.9 18.78 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.82 2.347 . . . . 0.0 112.433 -175.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.488 ' CG ' ' HZ1' ' A' ' 21' ' ' LYS . 42.5 t0 -122.82 162.63 21.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.95 -170.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -15.97 32.76 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 175.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.488 ' HZ1' ' CG ' ' A' ' 19' ' ' ASP . 2.2 mttp -90.55 6.58 43.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.668 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.719 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -98.24 -89.53 0.3 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.05 179.099 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 72.38 55.7 6.69 Favored Glycine 0 CA--C 1.521 0.451 0 CA-C-N 115.18 -0.918 . . . . 0.0 114.35 173.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.6 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 18.6 t30 -123.79 167.64 13.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 173.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.0 104.63 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.965 0.412 . . . . 0.0 110.142 176.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -102.05 178.6 4.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.117 0.484 . . . . 0.0 111.628 -174.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -100.88 135.77 41.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.106 177.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.494 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -47.05 -51.59 17.09 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.213 0.605 . . . . 0.0 112.605 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 29' ' ' ARG . 4.1 ptt180 -69.74 -16.13 63.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.541 -177.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.2 mmt180 -74.36 133.98 42.49 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.8 2.22 40.95 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.933 0.397 . . . . 0.0 110.651 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -133.76 150.16 51.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.351 -178.696 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.495 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 34.0 m -70.04 145.48 51.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.927 175.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -83.97 -45.37 13.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.642 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 9.2 mmt180 -91.73 -48.46 6.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.049 0.452 . . . . 0.0 111.498 -174.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -45.36 24.67 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.203 -173.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.59 23.01 14.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.798 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.495 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -96.0 -164.04 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.643 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.479 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.0 mp0 -125.26 158.48 33.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -72.47 74.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.106 0.479 . . . . 0.0 110.869 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 p -78.84 -63.7 1.35 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.289 0.566 . . . . 0.0 110.362 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.3 110.69 22.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.018 -179.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.451 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -142.16 121.9 1.89 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 121.152 -0.547 . . . . 0.0 111.886 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.451 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 5.8 Cg_exo -78.97 61.79 8.26 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.039 2.493 . . . . 0.0 112.288 -178.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 35.9 mt . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.124 179.007 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.27 -24.32 14.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.668 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.469 ' HB3' ' HE2' ' A' ' 3' ' ' MET . 26.1 ttp -105.52 111.17 23.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.812 -179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.67 118.67 33.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 173.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.6 m 68.94 127.39 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.689 0.618 . . . . 0.0 110.342 -170.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 108.85 0.74 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.979 0.419 . . . . 0.0 111.101 -177.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 p30 -97.89 17.9 17.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.179 0.514 . . . . 0.0 110.536 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.31 71.79 3.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.296 178.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.81 77.73 2.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.457 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 p -61.66 103.14 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.702 0.763 . . . . 0.0 109.877 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.28 164.05 20.32 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.54 -175.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.6 155.76 25.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 0.0 110.546 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.2 15.63 60.39 Favored Glycine 0 C--N 1.318 -0.455 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 -168.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -83.09 174.33 10.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.897 -1.152 . . . . 0.0 111.686 -175.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.523 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 24.1 p-90 -160.09 153.94 22.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.325 173.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.08 156.48 8.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . 3.7 t -43.85 143.72 1.64 Allowed Pre-proline 0 C--O 1.235 0.329 0 O-C-N 123.778 0.674 . . . . 0.0 111.124 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.523 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.6 Cg_exo -63.55 -20.44 69.53 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.376 2.051 . . . . 0.0 112.278 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -111.65 149.58 31.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.449 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.22 -1.74 50.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.392 -174.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -76.29 -15.29 60.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.402 0.62 . . . . 0.0 110.053 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.752 ' HB2' HH21 ' A' ' 38' ' ' ARG . 0.1 OUTLIER -110.3 -82.39 0.57 Allowed 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.705 178.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.75 17.68 80.06 Favored Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.294 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.854 ' HB2' ' HD3' ' A' ' 35' ' ' ARG . 14.9 t30 -62.59 134.7 56.75 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -80.05 90.24 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.674 0.75 . . . . 0.0 110.363 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -79.61 112.93 17.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.917 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -19.52 -79.5 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.102 1.501 . . . . 0.0 113.997 -175.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -176.5 -64.73 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.08 41.35 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.519 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.6 mmt-85 -108.82 104.89 14.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.575 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.92 -10.91 59.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.271 0.557 . . . . 0.0 111.187 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -141.38 146.71 36.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.731 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 31.0 t -56.99 145.66 29.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.008 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -89.11 -15.96 32.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.175 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.854 ' HD3' ' HB2' ' A' ' 24' ' ' ASN . 3.6 ttp180 -95.15 -44.01 7.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.417 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.581 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 15.3 p -127.31 -26.31 3.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.731 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 100.25 14.38 33.36 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.555 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.752 HH21 ' HB2' ' A' ' 22' ' ' CYS . 2.9 tpp180 -60.92 143.81 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.862 0.363 . . . . 0.0 110.693 176.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.44 155.71 39.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -72.59 67.3 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.975 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.3 129.26 42.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.785 178.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.66 124.24 42.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.816 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 139.24 -157.09 24.84 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.295 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -62.58 107.92 0.66 Allowed 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.144 2.563 . . . . 0.0 112.803 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.245 0.851 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.385 175.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.799 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.15 -164.72 1.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.78 102.98 0.82 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.676 0.274 . . . . 0.0 110.407 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.81 20.39 7.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.209 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m 60.55 44.02 12.19 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.53 -177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.6 39.21 1.03 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.833 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -87.24 95.95 10.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.425 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.3 t80 50.23 51.3 17.01 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.729 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.54 93.38 6.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.481 -175.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -89.86 104.55 15.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 171.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.8 -167.18 1.54 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.309 0.576 . . . . 0.0 112.001 -172.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -72.98 -46.68 50.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.816 -174.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -94.83 12.94 68.02 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.611 -175.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -76.12 163.06 27.48 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 0.0 110.19 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.501 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 1.1 p-90 -133.35 -167.06 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.266 -170.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.6 OUTLIER -122.36 -60.17 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 47.6 t -177.9 155.31 1.03 Allowed Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.617 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 23.1 Cg_exo -66.28 -13.48 40.04 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.967 1.778 . . . . 0.0 111.902 172.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -101.68 -173.61 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.794 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HZ1' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -129.38 -6.56 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.628 179.348 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -93.47 2.9 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.221 0.534 . . . . 0.0 110.012 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.454 ' HA ' HH21 ' A' ' 35' ' ' ARG . 5.8 t -104.21 -81.62 0.52 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.355 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.443 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.87 50.77 17.38 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.497 -0.858 . . . . 0.0 110.978 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.507 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 25.0 t30 -81.08 177.3 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.28 -0.46 . . . . 0.0 109.837 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.49 91.38 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.221 0.534 . . . . 0.0 110.204 175.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.729 HD21 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.78 151.97 25.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.284 0.564 . . . . 0.0 110.568 -179.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 1.9 t80 -81.64 148.03 29.25 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.134 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -43.26 -42.52 4.42 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.844 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -78.28 2.84 17.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.854 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.8 mmm180 -97.3 118.3 33.45 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 175.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -5.67 59.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.612 -177.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -140.62 159.94 41.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.478 -178.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.729 ' HA ' HD21 ' A' ' 26' ' ' ASN . 53.2 t -60.74 144.24 52.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.971 0.415 . . . . 0.0 109.901 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.406 ' HB2' HD22 ' A' ' 24' ' ' ASN . 0.2 OUTLIER -84.82 -8.42 58.81 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.454 HH21 ' HA ' ' A' ' 22' ' ' CYS . 0.3 OUTLIER -106.67 -52.84 2.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.171 178.801 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 86.1 m -78.73 -39.24 36.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.674 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.68 9.98 85.74 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.625 -0.797 . . . . 0.0 111.55 -175.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -88.94 143.12 27.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -70.66 156.2 39.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.377 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.39 110.16 1.36 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.711 173.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.79 -27.43 66.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.0 m -118.3 89.97 3.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.497 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -112.85 123.13 6.11 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.137 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -81.71 66.64 8.49 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.44 2.76 . . . . 0.0 111.653 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.799 0 CA-C-O 118.597 -0.716 . . . . 0.0 110.372 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.823 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.431 ' HB2' ' H ' ' A' ' 3' ' ' MET . 0.4 OUTLIER 49.06 -106.66 0.2 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.297 0.639 . . . . 0.0 112.005 179.487 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.431 ' H ' ' HB2' ' A' ' 2' ' ' SER . 0.0 OUTLIER -123.14 146.09 48.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.728 0.299 . . . . 0.0 110.483 -179.197 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 49.28 1.77 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.064 -178.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.56 -56.54 9.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.918 0.389 . . . . 0.0 111.535 -177.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.67 25.48 3.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.049 0.452 . . . . 0.0 110.69 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -78.47 -23.49 46.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.527 0.679 . . . . 0.0 110.139 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.93 -160.47 1.06 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.179 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.517 ' H ' ' HG3' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -101.25 122.4 43.59 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.953 179.376 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 t -87.34 81.41 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 171.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.532 ' HB2' ' H ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -82.63 -136.05 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.343 -171.191 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.532 ' H ' ' HB2' ' A' ' 11' ' ' SER . 0.4 OUTLIER -74.38 -68.17 0.55 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.999 -171.583 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.54 ' O ' ' HA ' ' A' ' 28' ' ' ALA . . . -82.95 -11.99 80.42 Favored Glycine 0 C--O 1.225 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.787 -173.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.55 101.37 1.6 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.858 0.361 . . . . 0.0 110.217 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.679 ' CZ3' ' HG3' ' A' ' 40' ' ' LYS . 50.9 p-90 -107.85 165.87 11.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.463 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.527 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.1 pp -106.32 150.48 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.762 175.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.86 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 56.7 m -41.09 150.42 0.31 Allowed Pre-proline 0 CA--C 1.537 0.447 0 O-C-N 124.45 1.094 . . . . 0.0 113.314 -177.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.937 ' HG3' ' HA ' ' A' ' 40' ' ' LYS . 34.3 Cg_exo -59.25 -31.12 94.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 123.368 2.712 . . . . 0.0 113.822 -174.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -114.91 167.88 10.4 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.015 0.436 . . . . 0.0 111.462 -173.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.85 -36.42 49.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.485 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -30.23 71.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.685 175.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.86 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -76.94 -83.72 0.07 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.852 177.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.463 ' N ' ' HB2' ' A' ' 17' ' ' CYS . . . 51.75 40.22 48.43 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.2 -0.909 . . . . 0.0 114.559 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.843 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 5.3 t30 -100.47 158.22 16.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 117.218 0.509 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.25 120.82 37.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.239 0.542 . . . . 0.0 110.579 177.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.31 177.47 4.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.545 -177.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.796 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 19.6 t80 -62.67 -93.38 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.702 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.54 ' HA ' ' O ' ' A' ' 13' ' ' GLY . . . -163.42 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.48 42.22 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.519 0.676 . . . . 0.0 110.591 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.796 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -92.11 138.99 31.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.761 177.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -31.7 18.55 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.728 0.299 . . . . 0.0 110.845 177.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.733 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -114.74 159.15 20.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.085 0.469 . . . . 0.0 112.07 -175.365 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -59.63 159.08 8.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.022 175.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.39 -21.54 17.12 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.876 -170.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -142.71 -30.73 0.53 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.35 -16.34 2.75 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -158.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' SG ' ' A' ' 33' ' ' CYS . . . -139.96 -112.61 1.01 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 119.28 -1.438 . . . . 0.0 114.596 -172.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HB3' ' H ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -159.95 -160.03 0.77 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.669 -0.265 . . . . 0.0 110.61 -167.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.733 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.7 mt-10 -64.51 149.5 48.52 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.937 ' HA ' ' HG3' ' A' ' 18' ' ' PRO . 1.7 tttm -65.49 107.46 1.69 Allowed 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.795 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.447 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 2.8 p -80.99 162.12 23.98 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.125 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.02 106.35 18.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.884 174.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.55 -143.42 8.35 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.516 -176.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.74 -5.68 14.84 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 123.102 2.535 . . . . 0.0 112.194 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.861 -0.59 . . . . 0.0 109.991 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.923 0 N-CA-C 111.944 -0.462 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.37 90.01 7.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.702 0.287 . . . . 0.0 111.275 -175.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.77 20.76 12.22 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.969 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.96 -52.39 4.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.117 0.484 . . . . 0.0 110.597 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.87 141.76 35.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.565 178.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 6' ' ' LYS . 5.3 mmtt -100.71 154.74 18.36 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.449 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.81 131.91 46.47 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.564 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.443 ' HB2' ' H ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -148.81 -158.54 0.93 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 176.247 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.443 ' H ' ' HB2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -100.29 85.39 2.98 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.102 0.477 . . . . 0.0 110.202 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.589 HG23 ' HB2' ' A' ' 12' ' ' ASP . 4.1 p -119.87 135.83 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.354 -178.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.8 m -98.39 75.43 2.23 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.854 0.835 . . . . 0.0 110.045 175.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.589 ' HB2' HG23 ' A' ' 10' ' ' VAL . 29.2 t70 -102.57 -121.45 0.18 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.707 -176.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.65 30.2 10.47 Favored Glycine 0 CA--C 1.508 -0.406 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -80.86 -169.01 2.0 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.464 -0.868 . . . . 0.0 111.521 -176.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.518 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p-90 -151.02 167.4 27.76 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -122.1 148.65 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 24' ' ' ASN . 4.0 m -39.61 141.67 0.7 Allowed Pre-proline 0 C--O 1.239 0.543 0 O-C-N 124.27 0.981 . . . . 0.0 113.095 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 31.2 Cg_exo -61.21 -25.04 80.15 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.426 2.084 . . . . 0.0 111.818 -176.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.465 ' OD2' ' HB3' ' A' ' 21' ' ' LYS . 12.2 t70 -112.47 123.67 50.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.827 178.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.04 11.45 2.73 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -170.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -76.51 -30.05 57.04 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.28 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.755 ' HA ' HH21 ' A' ' 35' ' ' ARG . 53.2 t -96.31 -70.03 0.73 Allowed 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.11 52.07 53.59 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.469 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 t30 -87.41 150.7 23.62 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.094 -177.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.88 88.08 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.183 0.516 . . . . 0.0 110.112 177.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.865 HD21 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.25 118.45 21.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.628 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -18.63 -82.49 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 O-C-N 125.13 1.518 . . . . 0.0 113.918 -170.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.45 -50.26 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.28 23.63 2.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.632 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' ' 32' ' ' SER . 0.6 OUTLIER -96.58 115.54 27.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.446 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.94 -1.35 52.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 175.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.466 ' O ' ' HB3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -145.42 163.98 32.94 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.551 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.961 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 25.2 t -64.58 167.97 6.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.81 0.814 . . . . 0.0 112.018 175.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.0 -4.87 26.67 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.547 170.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.755 HH21 ' HA ' ' A' ' 22' ' ' CYS . 1.0 OUTLIER -123.95 -66.72 0.97 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.871 -177.434 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.505 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 25.9 p -80.0 -23.49 41.51 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.064 0.459 . . . . 0.0 110.636 -175.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.961 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 78.0 7.56 87.53 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.406 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.505 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -66.58 140.01 57.93 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.85 143.2 32.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.262 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -63.32 96.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.701 -178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.83 115.02 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.642 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.91 115.76 30.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -173.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.416 ' HA3' ' HD3' ' A' ' 44' ' ' PRO . . . -174.08 -94.9 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.278 -0.729 . . . . 0.0 111.278 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.416 ' HD3' ' HA3' ' A' ' 43' ' ' GLY . 12.4 Cg_exo -71.28 -21.18 27.1 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.845 2.363 . . . . 0.0 111.084 172.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.264 0 CA-C-O 117.601 -1.19 . . . . 0.0 108.627 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.85 0 N-CA-C 112.312 -0.315 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.95 129.67 53.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.87 47.56 23.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.092 0.472 . . . . 0.0 111.069 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.54 102.35 3.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.522 -178.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.466 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -81.12 -105.48 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.466 ' H ' ' HB ' ' A' ' 5' ' ' THR . 6.1 mttt -101.27 166.58 10.69 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -91.11 83.54 5.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 0.0 109.797 176.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.55 39.94 0.97 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.098 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.403 ' NE ' ' HA ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -85.8 73.58 10.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.088 0.47 . . . . 0.0 110.222 179.266 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.5 t -78.56 105.79 8.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.08 171.35 12.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.889 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -81.69 144.83 30.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 174.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 94.99 -33.84 5.15 Favored Glycine 0 C--N 1.312 -0.788 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -171.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.33 146.08 54.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.5 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 14.1 p-90 -152.09 154.18 35.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.096 0.474 . . . . 0.0 111.134 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -109.96 160.71 8.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.457 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 9.2 t -45.99 144.24 3.0 Favored Pre-proline 0 N--CA 1.463 0.192 0 O-C-N 123.809 0.693 . . . . 0.0 111.12 -178.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.5 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 18.9 Cg_exo -66.56 -2.63 7.71 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.41 2.074 . . . . 0.0 112.464 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -112.33 163.98 13.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.977 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.81 -21.39 16.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.993 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -68.86 -29.53 67.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.361 0.6 . . . . 0.0 110.007 177.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.45 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -90.18 -83.01 0.26 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.102 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.428 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.21 35.28 64.03 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -175.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -67.43 144.29 55.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.325 -0.437 . . . . 0.0 110.136 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.83 87.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.602 0.715 . . . . 0.0 111.021 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.432 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -79.82 118.54 21.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.463 178.271 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -34.81 -75.13 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 124.125 0.891 . . . . 0.0 112.697 -177.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 176.69 -47.67 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -174.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.722 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -88.88 77.09 7.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 175.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 30' ' ' ARG . 2.0 mmt85 -151.79 117.88 5.55 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.13 -1.395 . . . . 0.0 108.688 -176.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -96.33 -7.41 35.33 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.276 0.56 . . . . 0.0 110.667 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -147.41 173.03 13.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.503 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 8.0 t -65.82 154.43 39.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.278 0.561 . . . . 0.0 111.564 176.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.53 -9.34 22.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.172 173.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -101.0 -69.4 0.78 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.077 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 28.5 p -91.21 -34.88 14.81 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.059 -174.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.736 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 105.39 7.25 37.66 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.28 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.445 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -57.95 140.53 51.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.027 0.441 . . . . 0.0 110.711 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.0 pm0 -72.75 171.11 13.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.844 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -76.33 58.92 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.242 0.544 . . . . 0.0 109.898 176.544 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 135.78 37.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.287 -177.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.8 -42.53 21.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.705 -179.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -120.51 124.39 5.88 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 178.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.01 127.6 25.66 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.07 2.514 . . . . 0.0 112.839 -178.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.9 mp . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.827 179.579 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.696 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.06 106.28 18.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.896 0.379 . . . . 0.0 110.338 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.18 139.31 22.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.262 -179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.74 124.72 25.41 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.425 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -27.05 68.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.745 -178.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -73.06 -54.4 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.013 0.435 . . . . 0.0 110.575 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -91.82 66.64 5.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.996 -176.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -86.71 51.82 2.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.732 176.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 68.32 10.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.634 -174.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.1 121.96 18.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 172.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.27 -136.96 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.318 0.58 . . . . 0.0 112.162 -169.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.95 -37.29 8.71 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.025 -178.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.13 -6.21 52.04 Favored Glycine 0 CA--C 1.521 0.437 0 CA-C-N 115.049 -0.978 . . . . 0.0 113.977 -176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.487 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -99.35 -175.45 3.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.096 0.448 . . . . 0.0 110.188 178.394 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.532 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 29.2 p-90 -160.39 157.26 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.624 0.25 . . . . 0.0 110.716 -176.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.8 pt -102.23 158.26 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 5.8 t -45.68 144.21 2.72 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 123.554 0.534 . . . . 0.0 111.806 -177.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.532 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 12.5 Cg_exo -72.67 1.52 6.24 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.023 2.482 . . . . 0.0 112.297 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.87 160.16 33.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.663 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -89.28 -19.93 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.831 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.674 ' HB2' HH22 ' A' ' 38' ' ' ARG . 31.3 mttt -62.42 -22.53 66.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.132 0.491 . . . . 0.0 110.874 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.411 ' HB3' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -101.91 -86.35 0.42 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.427 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 79.4 26.3 57.45 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.371 -174.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 7.8 t30 -80.02 134.86 36.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.591 -0.305 . . . . 0.0 110.924 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.66 114.78 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.976 0.417 . . . . 0.0 109.885 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.42 158.11 17.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.487 ' O ' ' HB3' ' A' ' 14' ' ' ASP . 35.2 t80 -53.3 -77.7 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 O-C-N 123.572 0.545 . . . . 0.0 112.055 -175.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.513 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -178.34 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.122 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.418 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -71.39 24.37 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.774 177.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 28' ' ' ALA . 11.7 mmt-85 -90.51 122.55 33.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.174 -177.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 -17.52 24.39 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.355 0.598 . . . . 0.0 109.631 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 50.8 m -132.35 168.41 18.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.397 174.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.412 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -64.0 164.51 10.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.937 0.875 . . . . 0.0 113.112 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -101.0 -24.69 14.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.213 170.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.58 -58.38 2.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.509 -171.292 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 31.2 p -93.65 -57.16 2.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.948 0.404 . . . . 0.0 110.753 -175.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.412 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.94 0.28 6.55 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.739 -178.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.674 HH22 ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.97 142.57 55.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.471 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.0 pm0 -87.63 172.87 9.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.416 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.66 67.86 0.8 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.858 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.3 t -80.32 -34.65 36.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.635 -175.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -60.97 1.95 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 0.0 110.722 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 152.26 -136.18 5.31 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.741 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -84.8 0.98 8.81 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.726 2.284 . . . . 0.0 112.331 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--O 1.25 1.083 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.631 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 112.255 -0.338 . . . . 0.0 112.255 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.518 ' O ' ' HB2' ' A' ' 3' ' ' MET . 0.0 OUTLIER -84.38 162.83 19.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.09 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.518 ' HB2' ' O ' ' A' ' 2' ' ' SER . 0.0 OUTLIER 79.67 -30.03 0.14 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.782 0.833 . . . . 0.0 112.025 176.854 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 106.35 3.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.374 178.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.25 107.88 18.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.709 178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -20.87 22.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.872 0.368 . . . . 0.0 110.575 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.34 131.05 36.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.053 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.15 101.68 1.9 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 178.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.16 78.82 1.77 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.434 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.96 102.5 3.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -80.46 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.604 0.716 . . . . 0.0 110.544 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -102.28 -149.53 0.39 Allowed 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.259 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.59 -123.06 4.78 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 111.278 -0.729 . . . . 0.0 111.278 -178.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.678 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 7.9 t70 -85.73 -62.29 1.56 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.635 0.731 . . . . 0.0 109.978 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.492 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 7.5 p-90 -160.16 161.24 33.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.743 -178.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -108.41 -75.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.781 177.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.84 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 1.5 m -147.53 152.67 42.35 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.596 ' HD2' ' SG ' ' A' ' 22' ' ' CYS . 17.4 Cg_exo -68.87 -30.01 27.36 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.036 2.491 . . . . 0.0 113.425 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -127.9 -175.2 3.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.054 0.454 . . . . 0.0 111.867 -173.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -93.13 -29.92 15.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.841 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -4.06 33.85 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.742 174.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.84 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -88.38 -85.33 0.19 Allowed 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.752 175.828 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.65 75.36 Favored Glycine 0 CA--C 1.518 0.253 0 CA-C-N 114.761 -1.109 . . . . 0.0 114.256 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.726 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 17.4 t30 -92.41 158.03 16.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.06 94.46 4.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.482 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -93.18 164.42 13.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.928 0.394 . . . . 0.0 110.613 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.425 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 t80 -83.91 -92.58 0.08 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.469 -173.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.678 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . . . -166.09 -62.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.247 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -81.01 21.61 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.221 0.534 . . . . 0.0 110.599 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 6.0 mtp85 -90.89 114.7 27.22 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.92 -0.67 57.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.264 0.554 . . . . 0.0 110.634 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -146.15 153.75 41.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.118 177.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.476 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 88.4 m -59.13 143.43 48.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.598 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -75.1 -37.66 61.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.995 176.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.21 -56.06 2.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.383 -175.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.419 ' HB2' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.46 -21.03 49.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.472 -173.505 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.424 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . 71.62 19.98 78.22 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.336 -0.459 . . . . 0.0 113.257 175.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.476 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 2.2 mmp_? -77.62 179.14 6.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.716 0.258 . . . . 0.0 110.538 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -103.85 151.56 22.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.078 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -69.17 89.7 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 110.415 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 t -101.3 179.46 4.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.151 178.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.3 m 75.32 -47.97 0.61 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.396 0.679 . . . . 0.0 110.986 -177.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -134.52 75.79 0.41 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.777 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.71 95.3 0.92 Allowed 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.133 2.555 . . . . 0.0 112.477 -177.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.754 176.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 111.806 -0.517 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.53 50.28 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.326 0.584 . . . . 0.0 110.421 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 9.3 tpt -86.96 78.05 9.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.548 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.39 85.27 2.52 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 173.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 118.8 15.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.146 -175.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.552 ' HE3' ' HB2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -84.74 99.82 11.11 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 170.74 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -76.23 10.99 1.68 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.007 -173.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.552 ' HB2' ' HE3' ' A' ' 6' ' ' LYS . 1.7 t80 -74.68 92.85 2.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.7 103.12 2.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.201 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.77 170.27 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.442 177.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.35 168.67 12.08 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.244 -179.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.63 -45.17 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.456 -175.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -80.11 -15.33 79.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.59 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -70.8 143.33 51.19 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.474 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -130.24 165.34 22.62 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.764 -171.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -110.17 156.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 1.006 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 23.1 m -46.17 146.8 2.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 O-C-N 123.951 0.782 . . . . 0.0 112.999 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.474 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -69.13 -18.43 39.96 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.987 2.458 . . . . 0.0 113.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -123.85 171.46 9.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.124 0.488 . . . . 0.0 111.641 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.91 -24.92 22.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.296 177.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -78.63 -12.0 60.0 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.251 173.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 1.006 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -87.45 -83.6 0.2 Allowed 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.546 174.072 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.99 36.41 90.2 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.766 171.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.815 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 6.4 t30 -104.78 159.28 15.91 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 117.333 0.566 . . . . 0.0 110.317 175.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.46 117.48 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 175.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.42 HD21 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -114.87 173.93 6.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.321 0.581 . . . . 0.0 111.456 -171.91 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -101.24 139.11 37.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.25 -179.834 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.25 -37.66 24.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.85 174.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.2 mtt-85 -84.09 18.22 2.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.919 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 0.8 OUTLIER -121.36 114.64 21.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.776 178.775 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.15 -9.58 59.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.089 0.471 . . . . 0.0 110.955 177.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.576 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -136.45 153.67 50.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 176.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' HA ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -60.53 174.65 0.54 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.144 0.973 . . . . 0.0 113.53 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -100.16 -26.12 14.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.745 -1.571 . . . . 0.0 110.049 177.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 35' ' ' ARG . 3.9 tpp180 -103.33 -65.41 1.01 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.528 -176.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -40.64 38.21 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.981 0.42 . . . . 0.0 111.75 -175.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.28 49.02 4.35 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.365 176.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.576 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.9 OUTLIER -105.68 153.83 21.29 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.288 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.32 140.7 29.83 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.44 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.7 tttm -67.39 100.78 0.87 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.721 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.45 108.88 13.32 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.358 -178.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.82 -33.35 68.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.362 0.601 . . . . 0.0 109.483 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.421 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -160.0 147.89 15.61 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.909 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.429 ' HB2' ' H ' ' A' ' 45' ' ' ILE . 19.6 Cg_exo -66.33 -97.31 0.0 OUTLIER 'Trans proline' 0 CA--C 1.528 0.22 0 C-N-CA 122.694 2.263 . . . . 0.0 111.956 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.429 ' H ' ' HB2' ' A' ' 44' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.499 -0.763 . . . . 0.0 110.117 177.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.889 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.7 m 69.55 -67.58 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.435 0.694 . . . . 0.0 111.455 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.3 tpp -112.54 112.38 23.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.757 0.313 . . . . 0.0 110.298 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.31 134.6 40.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.695 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.411 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -72.41 98.78 2.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.252 176.377 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -77.09 -39.27 50.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.183 0.516 . . . . 0.0 110.061 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -99.94 122.09 42.32 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 175.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.1 t80 61.35 80.2 0.23 Allowed 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 123.806 0.691 . . . . 0.0 109.594 -172.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' A' ' 5' ' ' THR . 4.3 mmm-85 -75.46 81.02 2.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.163 -174.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -83.52 82.89 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.405 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.62 34.76 2.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.054 172.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.44 -145.08 0.34 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.289 -172.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.69 19.58 36.3 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 3.3 p30 -73.37 176.22 6.21 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.158 -0.521 . . . . 0.0 110.465 178.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.521 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 32.7 p-90 -160.98 150.94 17.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.476 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.0 OUTLIER -102.3 157.53 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -43.15 140.54 2.02 Favored Pre-proline 0 C--O 1.236 0.353 0 O-C-N 123.886 0.741 . . . . 0.0 111.189 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.521 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 50.4 Cg_exo -56.26 -31.43 84.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.813 2.342 . . . . 0.0 112.661 -172.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.58 121.25 42.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttp -81.97 35.91 0.44 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -169.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -84.44 -14.16 50.07 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 165.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 t -108.12 -74.96 0.64 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.016 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 29.36 62.78 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.818 177.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.476 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 17.7 t30 -64.43 128.41 35.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.19 99.02 3.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.193 0.52 . . . . 0.0 109.748 178.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -84.26 147.11 27.42 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.5 -176.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -37.02 -73.46 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.57 1.169 . . . . 0.0 112.568 -175.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 178.47 -59.32 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.414 0.626 . . . . 0.0 109.71 178.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 29' ' ' ARG . 1.2 mmt180 -91.28 11.35 23.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.528 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.566 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -68.09 115.34 7.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.111 174.187 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.59 -21.64 35.11 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.832 0.349 . . . . 0.0 110.868 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.566 ' O ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -127.05 148.7 50.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.214 178.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.67 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 52.2 t -57.1 138.16 54.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.092 0.472 . . . . 0.0 110.913 178.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.15 -20.98 60.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.078 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 35' ' ' ARG . 1.9 mtm-85 -91.92 -55.22 3.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.279 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.5 m -85.65 -59.61 2.26 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.716 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.67 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.19 -3.19 28.31 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.26 140.82 58.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.63 148.36 30.29 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.617 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -55.03 99.99 0.03 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.223 0.535 . . . . 0.0 110.966 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 2.06 50.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.589 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.0 113.82 24.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.315 -178.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 96.59 111.27 2.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.469 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.38 175.28 5.56 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 123.005 2.47 . . . . 0.0 112.635 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.359 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.51 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 20.3 p-90 -130.88 170.53 14.3 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.7 0.286 . . . . 0.0 111.206 -174.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.1 pt -121.44 155.45 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.174 175.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -41.85 142.78 1.05 Allowed Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 124.022 0.826 . . . . 0.0 111.984 -179.102 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.3 Cg_exo -61.72 -21.25 71.71 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.653 2.236 . . . . 0.0 112.048 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -103.8 149.43 25.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.903 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.37 -6.17 57.86 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.319 -173.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -65.74 -41.46 92.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.439 0.638 . . . . 0.0 109.733 175.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.42 -79.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.357 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.14 30.01 70.03 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.511 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 15.1 t-20 -63.25 139.1 58.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.484 -0.358 . . . . 0.0 110.322 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -78.96 102.33 4.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.406 0.622 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.693 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 5.7 m120 -79.03 156.0 28.58 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.374 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.55 ' HB3' ' HG2' ' A' ' 30' ' ' ARG . 59.0 t80 -45.41 -82.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.03 0.831 . . . . 0.0 111.365 178.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 178.39 -66.65 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.97 53.72 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.768 173.185 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' A' ' 27' ' ' PHE . 55.0 mmt-85 -111.48 112.33 23.98 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.924 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -8.08 57.72 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.228 0.537 . . . . 0.0 109.722 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 1.5 m -140.56 152.41 45.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.509 174.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.785 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.6 t -53.63 152.7 4.92 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.494 0.664 . . . . 0.0 111.657 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.04 -18.93 32.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.355 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.31 -52.06 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.151 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 58.0 m -79.41 -53.86 6.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.39 0.614 . . . . 0.0 111.508 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.785 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 94.08 13.83 53.41 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -167.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.2 OUTLIER -81.28 145.14 31.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.219 -0.491 . . . . 0.0 109.877 178.071 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -69.83 143.99 52.72 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -171.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -59.19 107.22 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.042 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 . . . . . 0 C--O 1.237 0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 109.926 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.599 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 3.3 p-90 -156.48 -166.8 2.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.4 -75.48 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.188 0.518 . . . . 0.0 109.87 175.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.615 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 44.7 t -142.97 155.24 62.51 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 174.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.615 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 17.9 Cg_exo -68.42 -14.2 39.41 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.983 1.789 . . . . 0.0 110.975 176.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 21' ' ' LYS . 2.6 t0 -106.59 177.62 4.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.794 177.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.79 -10.94 9.44 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.838 0.352 . . . . 0.0 110.545 -179.075 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 9.0 pttm -85.21 -2.87 58.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.542 177.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.426 ' HA ' ' NH1' ' A' ' 35' ' ' ARG . 44.0 t -119.41 -86.76 0.64 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.568 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 59.64 4.61 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.809 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 16.2 t-20 -76.21 159.97 30.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.663 0.268 . . . . 0.0 110.723 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.85 62.1 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.228 0.537 . . . . 0.0 110.865 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.439 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 78.7 m-20 -89.53 125.7 35.3 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.409 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -84.15 171.51 12.77 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.03 -51.78 16.54 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -70.1 -12.48 61.63 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.572 ' O ' ' HZ2' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -79.23 86.46 5.0 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.504 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -0.79 12.66 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -142.06 135.39 29.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.75 0.31 . . . . 0.0 111.559 -177.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.439 ' HA ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 t -69.2 138.4 54.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.252 0.548 . . . . 0.0 109.886 174.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HA ' HH21 ' A' ' 38' ' ' ARG . 0.8 OUTLIER -100.43 2.52 42.3 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.637 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -104.87 -58.88 1.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.317 -174.627 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 24.7 p -93.26 -61.24 1.61 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.192 0.52 . . . . 0.0 111.661 -171.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 36' ' ' CYS . . . -133.5 -86.0 0.27 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.879 -175.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.456 HH21 ' HA ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -175.73 -132.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.681 0.24 . . . . 0.0 111.188 -169.175 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.432 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.59 145.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.77 0.828 . . . . 0.0 113.187 -173.527 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -64.34 104.36 0.76 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.968 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.422 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.039 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.475 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 8.8 p-90 -136.96 177.91 7.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.944 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.811 ' HB ' ' HA2' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -111.88 -108.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.155 -176.675 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.494 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.1 t -134.89 137.62 27.7 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.4 Cg_exo -62.55 -26.69 76.16 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.725 2.283 . . . . 0.0 112.395 -171.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HD3' ' A' ' 20' ' ' LYS . 6.8 t0 -147.1 178.03 8.7 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.591 ' HZ3' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER 72.46 150.66 0.1 Allowed 'General case' 0 N--CA 1.432 -1.333 0 CA-C-O 122.123 0.963 . . . . 0.0 110.345 175.821 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 39.01 0.16 Allowed 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.527 172.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.479 ' H ' ' C ' ' A' ' 20' ' ' LYS . 14.2 t -77.2 -78.6 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.112 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.811 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 70.54 36.93 68.56 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.767 178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 4.8 t30 -70.73 131.2 43.5 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -77.73 99.28 2.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.476 0.655 . . . . 0.0 110.53 -177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -85.4 151.32 24.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.447 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -48.41 -80.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 O-C-N 123.816 0.697 . . . . 0.0 111.56 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -59.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.508 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 0.5 OUTLIER -83.52 52.28 2.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.873 178.748 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.58 ' NH2' ' HA ' ' A' ' 34' ' ' ASP . 0.1 OUTLIER -122.46 117.57 26.29 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.515 174.859 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -82.69 -3.72 56.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.931 0.396 . . . . 0.0 110.824 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 9.8 m -141.84 154.98 45.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.366 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.425 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.9 t -58.36 136.46 57.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.163 0.506 . . . . 0.0 110.693 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.58 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 12.3 t70 -72.63 -11.42 60.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.349 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -108.47 -57.77 2.09 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.989 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.8 m -79.14 -37.8 37.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 111.904 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.425 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 85.54 11.45 74.7 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -171.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 133.06 36.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.4 OUTLIER -77.07 158.53 30.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.37 -174.801 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.98 78.7 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.904 172.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.709 -173.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.231 0.127 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.524 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -129.74 -10.74 4.43 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.161 0.981 . . . . 0.0 109.904 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.524 ' HB ' ' O ' ' A' ' 15' ' ' TRP . 7.8 mm 71.11 138.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.444 0 CA-C-N 112.751 -2.022 . . . . 0.0 109.642 -172.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.435 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 24.7 t -42.66 146.44 0.73 Allowed Pre-proline 0 C--O 1.24 0.561 0 C-N-CA 122.832 0.453 . . . . 0.0 111.999 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.5 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -68.31 -13.78 38.62 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.42 2.08 . . . . 0.0 111.379 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -98.18 -178.72 4.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.948 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.1 11.48 11.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.014 0.435 . . . . 0.0 110.567 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -97.97 -24.07 15.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.779 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.644 ' SG ' ' HB3' ' A' ' 35' ' ' ARG . 59.5 m -97.06 -73.11 0.62 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.409 0.623 . . . . 0.0 111.454 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 16' ' ' ILE . . . 69.52 37.17 78.06 Favored Glycine 0 N--CA 1.44 -1.047 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 -166.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.96 137.77 58.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.534 -0.833 . . . . 0.0 111.568 -176.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -86.62 87.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.018 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.7 166.76 21.48 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.715 -173.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -65.27 -74.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -179.09 -76.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.079 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 37.1 mmt-85 -77.45 42.79 0.36 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.067 -178.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.86 135.19 39.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 174.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 1.38 51.7 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.0 0.429 . . . . 0.0 110.504 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.98 155.63 41.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.591 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 40.7 t -67.78 155.1 40.07 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.5 176.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -17.57 17.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.373 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.644 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -88.19 -45.64 9.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.938 -178.323 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -113.45 -55.75 2.48 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.956 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.53 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 125.74 8.92 5.05 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.09 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -62.21 137.5 58.27 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -75.68 153.68 36.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.357 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -58.6 107.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.638 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 121.013 0.435 . . . . 0.0 111.482 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 . . . . . 0 CA--C 1.517 -0.297 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.507 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 23.5 p-90 -125.03 133.27 53.02 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.535 HG13 ' H ' ' A' ' 17' ' ' CYS . 0.9 OUTLIER -69.7 -55.51 14.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.703 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.535 ' H ' HG13 ' A' ' 16' ' ' ILE . 3.6 m -162.55 168.07 11.21 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.495 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 23.1 Cg_exo -64.74 -35.05 47.99 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.935 1.757 . . . . 0.0 111.19 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.707 ' HB3' ' HG2' ' A' ' 21' ' ' LYS . 29.8 t0 -155.17 163.4 40.25 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.116 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 31.78 0.16 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.937 0.399 . . . . 0.0 111.249 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.707 ' HG2' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -79.12 -38.98 34.8 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 173.341 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.65 -91.25 0.28 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.632 0.729 . . . . 0.0 109.408 170.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.48 64.69 0.45 Allowed Glycine 0 C--N 1.314 -0.685 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.717 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 51.4 t30 -105.8 -173.22 2.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.49 90.31 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.198 0.523 . . . . 0.0 109.676 174.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -95.3 167.49 11.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.519 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.691 ' HD2' ' HG2' ' A' ' 29' ' ' ARG . 3.9 t80 -102.22 144.05 31.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.955 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -51.11 -34.02 28.81 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.691 ' HG2' ' HD2' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -80.51 -3.84 51.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.944 0.402 . . . . 0.0 110.837 -179.208 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 15.9 mtt-85 -80.42 129.28 34.41 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.13 -12.73 40.24 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.295 0.569 . . . . 0.0 110.646 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.16 158.19 43.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.677 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' SG ' ' HD3' ' A' ' 18' ' ' PRO . 64.6 m -54.82 136.11 47.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.821 171.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.93 -41.9 18.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.894 0.378 . . . . 0.0 111.71 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -42.79 8.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.087 0.47 . . . . 0.0 110.745 -174.015 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.449 ' SG ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.94 -57.45 3.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.854 -176.873 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.456 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 111.31 19.94 7.29 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.487 -0.863 . . . . 0.0 114.638 174.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.449 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -91.91 167.37 12.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.853 0.827 . . . . 0.0 109.089 173.049 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pm0 -96.39 151.86 19.14 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 121.93 -0.482 . . . . 0.0 110.624 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.4 68.9 2.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.149 0.5 . . . . 0.0 110.071 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.767 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.234 0.285 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.712 ' HH2' HH12 ' A' ' 38' ' ' ARG . 6.6 p-90 -127.17 149.48 49.95 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.145 0.498 . . . . 0.0 110.903 -177.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' HA ' ' A' ' 25' ' ' VAL . 3.8 pt -98.8 -117.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.72 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.543 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 5.5 t -123.2 149.88 58.58 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 175.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.543 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 46.4 Cg_exo -57.18 -29.99 85.56 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.989 1.792 . . . . 0.0 112.444 -177.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 20' ' ' LYS . 18.7 t70 -110.97 -174.94 2.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.976 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 5.3 mtmm -103.27 -9.95 19.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.161 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -60.41 -37.8 82.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.112 0.482 . . . . 0.0 110.265 177.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.555 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -88.02 -79.74 0.29 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.509 0.671 . . . . 0.0 110.317 174.593 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.48 27.37 73.55 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -170.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 32.7 t30 -84.19 133.61 34.59 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.014 -0.593 . . . . 0.0 110.677 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.458 ' HA ' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -78.16 92.29 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.482 0.658 . . . . 0.0 110.492 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 34' ' ' ASP . 91.4 m-20 -79.93 -172.88 3.6 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.413 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.798 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 2.2 t80 -73.75 -131.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.09 -62.99 0.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.95 41.61 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.241 175.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.798 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -111.01 121.48 45.47 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.459 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.69 21.3 8.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.604 0.716 . . . . 0.0 109.933 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.2 m -153.99 150.69 28.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.446 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.916 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -63.54 158.5 20.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.404 0.621 . . . . 0.0 111.8 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 0.5 OUTLIER -92.9 -18.75 22.4 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.391 174.607 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.555 ' NH2' ' HA ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -104.44 -68.26 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.678 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.726 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 29.5 p -79.91 -30.4 40.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.195 0.521 . . . . 0.0 110.259 -176.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.916 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 87.72 6.68 76.23 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.881 -0.676 . . . . 0.0 113.926 168.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.726 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -73.04 166.85 22.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.633 0.717 . . . . 0.0 110.051 177.127 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.485 ' O ' ' HD2' ' A' ' 38' ' ' ARG . 20.3 pm0 -74.25 175.69 7.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.515 -177.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -77.52 55.08 1.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.849 0.833 . . . . 0.0 110.555 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.313 -0.995 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.393 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.352 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.469 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 39.6 p-90 -160.98 148.43 15.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.705 0.288 . . . . 0.0 110.618 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -99.92 157.12 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 6.2 m -47.62 144.69 4.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 123.879 0.737 . . . . 0.0 111.916 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' H ' ' A' ' 41' ' ' THR . 11.8 Cg_exo -69.62 -31.59 20.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.551 2.167 . . . . 0.0 113.981 -164.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 20' ' ' LYS . 4.7 t70 -116.04 172.15 7.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.139 0.495 . . . . 0.0 111.551 -174.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -77.95 -25.45 48.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.993 -178.827 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.3 mmtm -71.24 -16.29 62.49 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.485 0.66 . . . . 0.0 110.005 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 1.2 m -97.2 -85.81 0.35 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.55 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.01 14.24 67.86 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.177 -0.919 . . . . 0.0 113.65 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.764 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 1.7 t30 -80.23 153.65 28.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.939 0.399 . . . . 0.0 111.219 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -93.33 106.71 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.512 . . . . 0.0 110.07 174.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.593 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -87.95 176.36 7.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.029 -174.675 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -61.89 -89.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.401 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -65.14 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.539 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 3.0 mmt-85 -78.66 56.46 1.85 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.173 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.8 mmt-85 -126.43 129.93 49.7 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.599 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.71 -3.21 42.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.488 0.661 . . . . 0.0 109.864 172.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -130.98 166.41 21.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.491 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.695 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 85.2 m -56.9 169.48 0.51 Allowed 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.97 0.891 . . . . 0.0 113.176 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 26' ' ' ASN . 3.2 t70 -99.68 -41.35 7.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.44 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.509 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -105.78 -48.01 3.74 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.357 -177.508 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.27 -43.26 42.51 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -171.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.695 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 90.84 37.7 6.32 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.322 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -100.63 170.45 8.36 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.012 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -91.26 149.47 21.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -57.28 102.32 0.09 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.118 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.562 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.932 177.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.022 0.439 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.591 ' HH2' HH12 ' A' ' 38' ' ' ARG . 13.5 p-90 -130.36 171.56 12.81 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -112.16 -101.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.417 -176.593 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' NH2' ' A' ' 38' ' ' ARG . 6.5 t -146.1 148.2 34.43 Favored Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.0 Cg_exo -62.03 -28.08 80.04 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.113 1.875 . . . . 0.0 111.981 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.73 176.94 7.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.661 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 -14.16 12.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.137 -176.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -26.87 37.04 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.941 0.401 . . . . 0.0 110.171 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.28 -78.44 0.17 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.02 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.25 23.78 74.83 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.943 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 19.2 t-20 -65.91 135.47 54.81 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 122.161 0.184 . . . . 0.0 110.579 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -78.5 96.63 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.545 0.688 . . . . 0.0 109.811 176.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.763 HD21 ' HA ' ' A' ' 33' ' ' CYS . 5.3 m-80 -83.28 -174.46 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.126 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -76.64 -135.59 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.612 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -134.03 -50.46 0.82 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -87.56 13.4 10.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.907 175.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.96 125.79 29.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.023 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.89 -8.92 48.06 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.034 0.445 . . . . 0.0 110.507 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.2 149.33 50.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.808 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.763 ' HA ' HD21 ' A' ' 26' ' ' ASN . 2.9 t -62.59 160.62 13.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.028 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -100.76 -26.15 13.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.78 -64.98 1.03 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.079 -176.172 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 21.5 p -80.58 -40.07 26.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.596 -176.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.65 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.48 7.95 47.57 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.679 -0.772 . . . . 0.0 114.153 169.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.732 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -79.32 169.69 17.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.294 0.547 . . . . 0.0 110.941 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -90.05 155.84 18.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.89 0.376 . . . . 0.0 110.791 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -76.72 107.44 9.03 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.853 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.845 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 14.5 p-10 . . . . . 0 C--O 1.237 0.444 0 CA-C-O 121.243 0.544 . . . . 0.0 111.511 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CD2' ' HE2' ' A' ' 40' ' ' LYS . 12.1 p-90 -155.59 171.79 19.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.411 177.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.74 153.43 14.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 171.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.843 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 92.7 m -42.03 146.14 0.67 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.372 1.045 . . . . 0.0 112.516 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 31.4 Cg_exo -58.7 -28.04 85.21 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.94 2.427 . . . . 0.0 113.707 -172.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -121.24 177.17 5.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.162 0.506 . . . . 0.0 111.578 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.35 -27.43 19.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.185 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -70.32 -24.34 62.99 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -80.56 -82.43 0.12 Allowed 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.492 171.916 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.96 47.66 59.36 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.353 -0.84 . . . . 0.0 114.913 174.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.843 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 3.3 t30 -105.66 155.61 19.07 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 117.075 0.438 . . . . 0.0 110.847 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.422 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -85.2 110.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.916 173.635 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -88.69 160.78 17.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.401 -177.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -51.72 -76.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.652 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 179.67 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.711 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.22 51.88 1.89 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.228 0.537 . . . . 0.0 110.381 179.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -108.31 128.49 54.79 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.419 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.97 7.22 43.15 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.963 0.411 . . . . 0.0 110.913 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.77 156.27 44.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.726 177.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 153.69 11.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 175.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.86 -7.93 23.07 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -169.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.89 -36.89 0.2 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -172.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.55 -29.4 3.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -160.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.72 -109.73 2.1 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.196 -1.002 . . . . 0.0 113.514 -170.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.423 ' HB3' ' H ' ' A' ' 39' ' ' GLU . 2.9 mmt180 -171.19 -156.56 0.12 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.391 0.139 . . . . 0.0 110.979 -171.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.423 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.9 148.63 0.52 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.457 ' HE2' ' CD2' ' A' ' 15' ' ' TRP . 35.0 tttm -59.59 92.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.945 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.305 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.518 -0.254 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.558 ' CE2' ' HG3' ' A' ' 40' ' ' LYS . 12.5 p-90 -161.07 164.18 30.97 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.983 0.421 . . . . 0.0 111.213 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pt -115.31 159.53 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 36.8 t -46.28 141.0 5.03 Favored Pre-proline 0 C--O 1.236 0.373 0 O-C-N 123.744 0.653 . . . . 0.0 111.669 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.557 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 7.6 Cg_exo -76.79 -10.56 18.37 Favored 'Trans proline' 0 N--CA 1.446 -1.299 0 C-N-CA 122.02 1.813 . . . . 0.0 111.435 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -106.46 160.64 15.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.653 -174.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -96.25 20.05 10.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.236 -176.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 -35.75 12.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.065 0.459 . . . . 0.0 109.8 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.1 m -99.28 -79.26 0.49 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.526 0.679 . . . . 0.0 111.475 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.73 21.72 76.23 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 -165.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.41 144.43 57.17 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 113.507 -1.347 . . . . 0.0 110.525 -176.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.64 99.14 8.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.375 0.607 . . . . 0.0 109.8 174.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.55 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 3.5 m120 -78.7 163.2 25.62 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.816 -176.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.28 -85.24 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.556 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.412 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . 179.98 -58.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.428 ' HA ' ' HD2' ' A' ' 29' ' ' ARG . 7.4 mmm180 -78.11 31.74 0.18 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.62 175.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' H ' ' C ' ' A' ' 28' ' ' ALA . 63.6 mmt-85 -98.53 121.35 40.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.225 -176.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.69 -5.55 51.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.118 0.485 . . . . 0.0 110.435 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.1 m -142.82 168.1 20.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.331 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.841 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 17.2 t -63.06 156.93 23.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.593 0.711 . . . . 0.0 111.585 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -96.11 -9.78 29.91 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.142 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -110.89 -59.85 1.91 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.829 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.0 p -94.52 -55.12 3.26 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.192 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.841 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.71 9.03 4.08 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.505 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -64.19 149.78 47.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.927 0.364 . . . . 0.0 110.439 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.43 155.74 37.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.615 0.245 . . . . 0.0 111.003 -175.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.558 ' HG3' ' CE2' ' A' ' 15' ' ' TRP . 17.4 tttm -64.17 90.39 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.501 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.338 -176.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . 4.2 m-20 . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.528 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 6.4 p-90 -145.66 153.84 41.45 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.104 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.8 -80.02 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 4.6 m -149.92 151.67 32.75 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.647 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 10.0 Cg_exo -75.18 -17.9 18.78 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.82 2.347 . . . . 0.0 112.433 -175.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 22' ' ' CYS . 42.5 t0 -122.82 162.63 21.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.95 -170.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -15.97 32.76 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 175.075 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -90.55 6.58 43.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.668 174.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -98.24 -89.53 0.3 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.05 179.099 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.476 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 72.38 55.7 6.69 Favored Glycine 0 CA--C 1.521 0.451 0 CA-C-N 115.18 -0.918 . . . . 0.0 114.35 173.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.611 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 15.7 t-20 -123.79 167.64 13.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 173.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.0 104.63 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.965 0.412 . . . . 0.0 110.142 176.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -102.05 178.6 4.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.117 0.484 . . . . 0.0 111.628 -174.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.457 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -100.88 135.77 41.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.106 177.0 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB2' ' HA ' ' A' ' 14' ' ' ASP . . . -47.05 -51.59 17.09 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.213 0.605 . . . . 0.0 112.605 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 29' ' ' ARG . 4.1 ptt180 -69.74 -16.13 63.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.541 -177.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.2 mmt180 -74.36 133.98 42.49 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.8 2.22 40.95 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.933 0.397 . . . . 0.0 110.651 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -133.76 150.16 51.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.351 -178.696 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.54 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 34.0 m -70.04 145.48 51.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.927 175.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -83.97 -45.37 13.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.642 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 9.2 mmt180 -91.73 -48.46 6.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.049 0.452 . . . . 0.0 111.498 -174.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -45.36 24.67 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.203 -173.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.59 23.01 14.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.798 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.54 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -96.0 -164.04 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.643 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.496 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.0 mp0 -125.26 158.48 33.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -72.47 74.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.106 0.479 . . . . 0.0 110.869 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.319 -0.731 0 CA-C-O 121.289 0.566 . . . . 0.0 110.362 179.316 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.134 0.492 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.509 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 24.1 p-90 -160.09 153.94 22.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.325 173.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.08 156.48 8.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.426 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . 3.7 t -43.85 143.72 1.64 Allowed Pre-proline 0 C--O 1.235 0.329 0 O-C-N 123.778 0.674 . . . . 0.0 111.124 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.509 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.6 Cg_exo -63.55 -20.44 69.53 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.376 2.051 . . . . 0.0 112.278 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -111.65 149.58 31.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.449 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.22 -1.74 50.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.392 -174.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -76.29 -15.29 60.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.402 0.62 . . . . 0.0 110.053 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB2' HH21 ' A' ' 38' ' ' ARG . 0.1 OUTLIER -110.3 -82.39 0.57 Allowed 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.705 178.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.75 17.68 80.06 Favored Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.294 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.839 ' HB2' ' HD3' ' A' ' 35' ' ' ARG . 29.0 t-20 -62.59 134.7 56.75 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -80.05 90.24 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.674 0.75 . . . . 0.0 110.363 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -79.61 112.93 17.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.917 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -19.52 -79.5 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.102 1.501 . . . . 0.0 113.997 -175.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -176.5 -64.73 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.08 41.35 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.519 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.6 mmt-85 -108.82 104.89 14.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.575 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.92 -10.91 59.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.271 0.557 . . . . 0.0 111.187 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -141.38 146.71 36.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.796 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 31.0 t -56.99 145.66 29.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.008 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -89.11 -15.96 32.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.175 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.839 ' HD3' ' HB2' ' A' ' 24' ' ' ASN . 3.6 ttp180 -95.15 -44.01 7.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.417 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.585 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 15.3 p -127.31 -26.31 3.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.796 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 100.25 14.38 33.36 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.555 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.76 HH21 ' HB2' ' A' ' 22' ' ' CYS . 2.9 tpp180 -60.92 143.81 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.862 0.363 . . . . 0.0 110.693 176.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.44 155.71 39.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -72.59 67.3 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.975 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.785 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 . . . . . 0 C--O 1.236 0.361 0 CA-C-O 120.845 0.355 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.481 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 1.1 p-90 -133.35 -167.06 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.266 -170.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.6 OUTLIER -122.36 -60.17 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 47.6 t -177.9 155.31 1.03 Allowed Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.635 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 23.1 Cg_exo -66.28 -13.48 40.04 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.967 1.778 . . . . 0.0 111.902 172.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -101.68 -173.61 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.794 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -6.56 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.628 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -93.47 2.9 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.221 0.534 . . . . 0.0 110.012 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.488 ' HA ' HH21 ' A' ' 35' ' ' ARG . 5.8 t -104.21 -81.62 0.52 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.355 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.87 50.77 17.38 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.497 -0.858 . . . . 0.0 110.978 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.498 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 18.5 t-20 -81.08 177.3 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.28 -0.46 . . . . 0.0 109.837 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.49 91.38 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.221 0.534 . . . . 0.0 110.204 175.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.778 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.78 151.97 25.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.284 0.564 . . . . 0.0 110.568 -179.151 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 1.9 t80 -81.64 148.03 29.25 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.134 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -43.26 -42.52 4.42 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.844 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -78.28 2.84 17.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.854 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.8 mmm180 -97.3 118.3 33.45 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 175.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -5.67 59.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.612 -177.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -140.62 159.94 41.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.478 -178.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HA ' HD22 ' A' ' 26' ' ' ASN . 53.2 t -60.74 144.24 52.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.971 0.415 . . . . 0.0 109.901 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.82 -8.42 58.81 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.488 HH21 ' HA ' ' A' ' 22' ' ' CYS . 0.3 OUTLIER -106.67 -52.84 2.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.171 178.801 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 86.1 m -78.73 -39.24 36.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.674 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.68 9.98 85.74 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.625 -0.797 . . . . 0.0 111.55 -175.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -88.94 143.12 27.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -70.66 156.2 39.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.377 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.39 110.16 1.36 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.711 173.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.235 0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.696 ' CZ3' ' HG3' ' A' ' 40' ' ' LYS . 50.9 p-90 -107.85 165.87 11.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.463 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.521 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.1 pp -106.32 150.48 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.762 175.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 56.7 m -41.09 150.42 0.31 Allowed Pre-proline 0 CA--C 1.537 0.447 0 O-C-N 124.45 1.094 . . . . 0.0 113.314 -177.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.974 ' HG3' ' HA ' ' A' ' 40' ' ' LYS . 34.3 Cg_exo -59.25 -31.12 94.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 123.368 2.712 . . . . 0.0 113.822 -174.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -114.91 167.88 10.4 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.015 0.436 . . . . 0.0 111.462 -173.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.85 -36.42 49.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.485 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -30.23 71.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.685 175.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -76.94 -83.72 0.07 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.852 177.825 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.481 ' N ' ' HB2' ' A' ' 17' ' ' CYS . . . 51.75 40.22 48.43 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.2 -0.909 . . . . 0.0 114.559 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.848 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 5.3 t30 -100.47 158.22 16.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 117.218 0.509 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.25 120.82 37.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.239 0.542 . . . . 0.0 110.579 177.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.31 177.47 4.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.545 -177.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.832 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 19.6 t80 -62.67 -93.38 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.702 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -163.42 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.48 42.22 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.519 0.676 . . . . 0.0 110.591 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.832 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -92.11 138.99 31.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.761 177.038 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -31.7 18.55 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.728 0.299 . . . . 0.0 110.845 177.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.765 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -114.74 159.15 20.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.085 0.469 . . . . 0.0 112.07 -175.365 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -59.63 159.08 8.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.022 175.964 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.39 -21.54 17.12 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.876 -170.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -142.71 -30.73 0.53 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.35 -16.34 2.75 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -158.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' SG ' ' A' ' 33' ' ' CYS . . . -139.96 -112.61 1.01 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 119.28 -1.438 . . . . 0.0 114.596 -172.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.95 -160.03 0.77 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.669 -0.265 . . . . 0.0 110.61 -167.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.765 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.7 mt-10 -64.51 149.5 48.52 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.974 ' HA ' ' HG3' ' A' ' 18' ' ' PRO . 1.7 tttm -65.49 107.46 1.69 Allowed 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.795 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.498 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 2.8 p . . . . . 0 C--N 1.318 -0.794 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.125 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.368 0.604 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.508 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p-90 -151.02 167.4 27.76 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -122.1 148.65 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 24' ' ' ASN . 4.0 m -39.61 141.67 0.7 Allowed Pre-proline 0 C--O 1.239 0.543 0 O-C-N 124.27 0.981 . . . . 0.0 113.095 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.508 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 31.2 Cg_exo -61.21 -25.04 80.15 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.426 2.084 . . . . 0.0 111.818 -176.036 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 21' ' ' LYS . 12.2 t70 -112.47 123.67 50.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.827 178.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.04 11.45 2.73 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -170.067 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -76.51 -30.05 57.04 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.28 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.8 ' HA ' HH21 ' A' ' 35' ' ' ARG . 53.2 t -96.31 -70.03 0.73 Allowed 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.11 52.07 53.59 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.469 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 t30 -87.41 150.7 23.62 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.094 -177.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.88 88.08 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.183 0.516 . . . . 0.0 110.112 177.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.533 ' ND2' ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -79.25 118.45 21.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.628 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -18.63 -82.49 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 O-C-N 125.13 1.518 . . . . 0.0 113.918 -170.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.45 -50.26 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.28 23.63 2.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.632 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 32' ' ' SER . 0.6 OUTLIER -96.58 115.54 27.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.446 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.94 -1.35 52.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 175.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -145.42 163.98 32.94 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.551 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 1.002 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 25.2 t -64.58 167.97 6.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.81 0.814 . . . . 0.0 112.018 175.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.0 -4.87 26.67 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.547 170.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.8 HH21 ' HA ' ' A' ' 22' ' ' CYS . 1.0 OUTLIER -123.95 -66.72 0.97 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.871 -177.434 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 25.9 p -80.0 -23.49 41.51 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.064 0.459 . . . . 0.0 110.636 -175.28 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 1.002 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 78.0 7.56 87.53 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.406 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.512 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -66.58 140.01 57.93 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.85 143.2 32.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.262 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -63.32 96.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.701 -178.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.772 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.642 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.234 0.283 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.483 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 14.1 p-90 -152.09 154.18 35.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.096 0.474 . . . . 0.0 111.134 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -109.96 160.71 8.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.485 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 9.2 t -45.99 144.24 3.0 Favored Pre-proline 0 N--CA 1.463 0.192 0 O-C-N 123.809 0.693 . . . . 0.0 111.12 -178.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.485 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 18.9 Cg_exo -66.56 -2.63 7.71 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.41 2.074 . . . . 0.0 112.464 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -112.33 163.98 13.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.977 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.81 -21.39 16.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.993 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HG2' ' N ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -68.86 -29.53 67.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.361 0.6 . . . . 0.0 110.007 177.688 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.444 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -90.18 -83.01 0.26 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.102 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.21 35.28 64.03 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -175.548 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.43 144.29 55.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.325 -0.437 . . . . 0.0 110.136 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.83 87.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.602 0.715 . . . . 0.0 111.021 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.448 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -79.82 118.54 21.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.463 178.271 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -34.81 -75.13 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 124.125 0.891 . . . . 0.0 112.697 -177.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 176.69 -47.67 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -174.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.723 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -88.88 77.09 7.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 175.797 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 30' ' ' ARG . 2.0 mmt85 -151.79 117.88 5.55 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.13 -1.395 . . . . 0.0 108.688 -176.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -96.33 -7.41 35.33 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.276 0.56 . . . . 0.0 110.667 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -147.41 173.03 13.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.503 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.823 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 8.0 t -65.82 154.43 39.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.278 0.561 . . . . 0.0 111.564 176.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.53 -9.34 22.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.172 173.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -101.0 -69.4 0.78 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.077 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 28.5 p -91.21 -34.88 14.81 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.059 -174.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.823 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 105.39 7.25 37.66 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.28 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.465 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -57.95 140.53 51.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.027 0.441 . . . . 0.0 110.711 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.0 pm0 -72.75 171.11 13.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.844 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -76.33 58.92 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.242 0.544 . . . . 0.0 109.898 176.544 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.287 -177.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.229 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.518 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 29.2 p-90 -160.39 157.26 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.624 0.25 . . . . 0.0 110.716 -176.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.8 pt -102.23 158.26 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 5.8 t -45.68 144.21 2.72 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 123.554 0.534 . . . . 0.0 111.806 -177.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 12.5 Cg_exo -72.67 1.52 6.24 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.023 2.482 . . . . 0.0 112.297 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.87 160.16 33.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.663 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -89.28 -19.93 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.831 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.703 ' HB2' HH22 ' A' ' 38' ' ' ARG . 31.3 mttt -62.42 -22.53 66.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.132 0.491 . . . . 0.0 110.874 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -86.35 0.42 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.427 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.4 26.3 57.45 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.371 -174.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 7.8 t30 -80.02 134.86 36.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.591 -0.305 . . . . 0.0 110.924 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.66 114.78 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.976 0.417 . . . . 0.0 109.885 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.42 158.11 17.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.499 ' O ' ' HB3' ' A' ' 14' ' ' ASP . 35.2 t80 -53.3 -77.7 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 O-C-N 123.572 0.545 . . . . 0.0 112.055 -175.114 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -178.34 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.122 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -71.39 24.37 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.774 177.336 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 32' ' ' SER . 11.7 mmt-85 -90.51 122.55 33.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.174 -177.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 -17.52 24.39 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.355 0.598 . . . . 0.0 109.631 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 50.8 m -132.35 168.41 18.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.397 174.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.484 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -64.0 164.51 10.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.937 0.875 . . . . 0.0 113.112 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -101.0 -24.69 14.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.213 170.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.58 -58.38 2.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.509 -171.292 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.516 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 31.2 p -93.65 -57.16 2.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.948 0.404 . . . . 0.0 110.753 -175.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.484 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.94 0.28 6.55 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.739 -178.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.703 HH22 ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.97 142.57 55.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.0 pm0 -87.63 172.87 9.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.416 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.66 67.86 0.8 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.858 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.635 -175.578 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.679 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 7.9 t70 . . . . . 0 CA--C 1.515 -0.367 0 CA-C-O 121.635 0.731 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.465 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 7.5 p-90 -160.16 161.24 33.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.743 -178.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -108.41 -75.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.781 177.996 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 1.5 m -147.53 152.67 42.35 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.736 ' HB3' HG22 ' A' ' 41' ' ' THR . 17.4 Cg_exo -68.87 -30.01 27.36 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.036 2.491 . . . . 0.0 113.425 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -127.9 -175.2 3.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.054 0.454 . . . . 0.0 111.867 -173.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -93.13 -29.92 15.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.841 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -4.06 33.85 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.742 174.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -88.38 -85.33 0.19 Allowed 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.752 175.828 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.65 75.36 Favored Glycine 0 CA--C 1.518 0.253 0 CA-C-N 114.761 -1.109 . . . . 0.0 114.256 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 21.4 t-20 -92.41 158.03 16.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.06 94.46 4.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.482 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -93.18 164.42 13.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.928 0.394 . . . . 0.0 110.613 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.453 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 t80 -83.91 -92.58 0.08 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.469 -173.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.679 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . . . -166.09 -62.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.247 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -81.01 21.61 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.221 0.534 . . . . 0.0 110.599 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 6.0 mtp85 -90.89 114.7 27.22 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.065 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.92 -0.67 57.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.264 0.554 . . . . 0.0 110.634 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -146.15 153.75 41.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.118 177.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.468 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 88.4 m -59.13 143.43 48.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.598 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -75.1 -37.66 61.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.995 176.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.459 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 0.4 OUTLIER -101.21 -56.06 2.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.383 -175.565 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.46 -21.03 49.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.472 -173.505 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.462 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . 71.62 19.98 78.22 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.336 -0.459 . . . . 0.0 113.257 175.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.468 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 2.2 mmp_? -77.62 179.14 6.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.716 0.258 . . . . 0.0 110.538 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -103.85 151.56 22.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.078 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -69.17 89.7 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 110.415 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.736 HG22 ' HB3' ' A' ' 18' ' ' PRO . 1.5 t . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.151 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 CA--C 1.52 -0.2 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.443 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -130.24 165.34 22.62 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.764 -171.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -110.17 156.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 23.1 m -46.17 146.8 2.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 O-C-N 123.951 0.782 . . . . 0.0 112.999 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -69.13 -18.43 39.96 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.987 2.458 . . . . 0.0 113.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -123.85 171.46 9.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.124 0.488 . . . . 0.0 111.641 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.91 -24.92 22.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.296 177.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -78.63 -12.0 60.0 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.251 173.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -87.45 -83.6 0.2 Allowed 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.546 174.072 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.99 36.41 90.2 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.766 171.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.823 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 14.0 t-20 -104.78 159.28 15.91 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 117.333 0.566 . . . . 0.0 110.317 175.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.46 117.48 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 175.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.442 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -114.87 173.93 6.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.321 0.581 . . . . 0.0 111.456 -171.91 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -101.24 139.11 37.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.25 -179.834 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.25 -37.66 24.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.85 174.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.2 mtt-85 -84.09 18.22 2.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.919 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 0.8 OUTLIER -121.36 114.64 21.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.776 178.775 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.15 -9.58 59.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.089 0.471 . . . . 0.0 110.955 177.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -136.45 153.67 50.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 176.784 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.442 ' HA ' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -60.53 174.65 0.54 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.144 0.973 . . . . 0.0 113.53 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -100.16 -26.12 14.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.745 -1.571 . . . . 0.0 110.049 177.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -103.33 -65.41 1.01 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.528 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -40.64 38.21 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.981 0.42 . . . . 0.0 111.75 -175.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.437 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 86.28 49.02 4.35 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.365 176.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.598 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.9 OUTLIER -105.68 153.83 21.29 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.288 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.32 140.7 29.83 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.44 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.7 tttm -67.39 100.78 0.87 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.721 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.358 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.45 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 3.3 p30 . . . . . 0 C--O 1.235 0.323 0 CA-C-O 120.965 0.412 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.511 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 32.7 p-90 -160.98 150.94 17.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.0 OUTLIER -102.3 157.53 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.97 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -43.15 140.54 2.02 Favored Pre-proline 0 C--O 1.236 0.353 0 O-C-N 123.886 0.741 . . . . 0.0 111.189 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 50.4 Cg_exo -56.26 -31.43 84.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.813 2.342 . . . . 0.0 112.661 -172.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.58 121.25 42.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttp -81.97 35.91 0.44 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -169.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -84.44 -14.16 50.07 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 165.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 t -108.12 -74.96 0.64 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.016 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 29.36 62.78 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.818 177.608 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 17.7 t30 -64.43 128.41 35.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.43 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.0 OUTLIER -79.19 99.02 3.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.193 0.52 . . . . 0.0 109.748 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -84.26 147.11 27.42 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.5 -176.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -37.02 -73.46 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.57 1.169 . . . . 0.0 112.568 -175.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 178.47 -59.32 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.414 0.626 . . . . 0.0 109.71 178.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 29' ' ' ARG . 1.2 mmt180 -91.28 11.35 23.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.528 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.583 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -68.09 115.34 7.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.111 174.187 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.59 -21.64 35.11 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.832 0.349 . . . . 0.0 110.868 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.583 ' O ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -127.05 148.7 50.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.214 178.591 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.711 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 52.2 t -57.1 138.16 54.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.092 0.472 . . . . 0.0 110.913 178.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.15 -20.98 60.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.078 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 35' ' ' ARG . 1.9 mtm-85 -91.92 -55.22 3.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.279 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.5 m -85.65 -59.61 2.26 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.716 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.711 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.19 -3.19 28.31 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -65.26 140.82 58.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 176.976 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.63 148.36 30.29 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.617 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -55.03 99.99 0.03 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.223 0.535 . . . . 0.0 110.966 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.589 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.11 159.66 31.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.637 0.256 . . . . 0.0 111.381 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.64 83.71 0.15 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.254 178.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.71 103.2 0.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.807 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.15 130.91 53.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.15 -29.41 60.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.447 0.641 . . . . 0.0 109.596 175.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -93.17 165.03 13.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.283 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD2' HG12 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -89.64 -165.84 1.45 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.357 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.1 mmt-85 -91.59 49.43 1.58 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.536 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -156.31 161.64 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.622 -174.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.74 -160.53 0.8 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.878 0.371 . . . . 0.0 111.455 -177.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.21 -51.43 17.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.838 -176.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.93 -45.46 10.47 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.853 -174.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.79 143.36 44.04 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.51 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 20.3 p-90 -130.88 170.53 14.3 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.7 0.286 . . . . 0.0 111.206 -174.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.1 pt -121.44 155.45 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.174 175.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -41.85 142.78 1.05 Allowed Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 124.022 0.826 . . . . 0.0 111.984 -179.102 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.3 Cg_exo -61.72 -21.25 71.71 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.653 2.236 . . . . 0.0 112.048 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -103.8 149.43 25.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.903 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.37 -6.17 57.86 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.319 -173.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -65.74 -41.46 92.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.439 0.638 . . . . 0.0 109.733 175.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.42 -79.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.357 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.14 30.01 70.03 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.511 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 15.1 t-20 -63.25 139.1 58.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.484 -0.358 . . . . 0.0 110.322 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -78.96 102.33 4.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.406 0.622 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.693 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 5.7 m120 -79.03 156.0 28.58 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.374 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.55 ' HB3' ' HG2' ' A' ' 30' ' ' ARG . 59.0 t80 -45.41 -82.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.03 0.831 . . . . 0.0 111.365 178.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 178.39 -66.65 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.97 53.72 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.768 173.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' A' ' 27' ' ' PHE . 55.0 mmt-85 -111.48 112.33 23.98 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.924 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -8.08 57.72 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.228 0.537 . . . . 0.0 109.722 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 1.5 m -140.56 152.41 45.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.509 174.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.785 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.6 t -53.63 152.7 4.92 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.494 0.664 . . . . 0.0 111.657 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.04 -18.93 32.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.355 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.31 -52.06 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.151 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 58.0 m -79.41 -53.86 6.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.39 0.614 . . . . 0.0 111.508 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.785 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 94.08 13.83 53.41 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -167.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.2 OUTLIER -81.28 145.14 31.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.219 -0.491 . . . . 0.0 109.877 178.071 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -69.83 143.99 52.72 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -171.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -59.19 107.22 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.042 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.9 169.4 15.25 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -177.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.26 -63.02 1.17 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.874 177.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.435 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . 86.71 142.11 6.92 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.899 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.435 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 2.9 Cg_exo -76.43 -178.06 4.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.995 2.464 . . . . 0.0 111.507 176.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.0 mm . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.24 179.785 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.778 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m 53.91 54.0 10.41 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.813 0.445 . . . . 0.0 112.182 176.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -67.16 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 172.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.77 -42.85 17.45 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.435 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER 62.66 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.105 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.435 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -101.02 153.28 19.68 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -177.732 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -70.59 120.54 16.36 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -74.53 109.47 8.04 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 121.62 0.724 . . . . 0.0 110.815 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.49 137.12 36.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.445 173.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.434 ' H ' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -65.46 132.57 31.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.742 0.306 . . . . 0.0 110.344 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.92 176.53 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.199 -177.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.86 -39.65 93.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.513 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -90.82 4.55 81.86 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.351 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -83.75 -172.82 4.36 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 109.926 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.599 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 3.3 p-90 -156.48 -166.8 2.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.4 -75.48 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.188 0.518 . . . . 0.0 109.87 175.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.615 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 44.7 t -142.97 155.24 62.51 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 174.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.615 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 17.9 Cg_exo -68.42 -14.2 39.41 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.983 1.789 . . . . 0.0 110.975 176.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 21' ' ' LYS . 2.6 t0 -106.59 177.62 4.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.794 177.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.79 -10.94 9.44 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.838 0.352 . . . . 0.0 110.545 -179.075 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 9.0 pttm -85.21 -2.87 58.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.542 177.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.426 ' HA ' ' NH1' ' A' ' 35' ' ' ARG . 44.0 t -119.41 -86.76 0.64 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.568 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 59.64 4.61 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.809 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 16.2 t-20 -76.21 159.97 30.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.663 0.268 . . . . 0.0 110.723 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.85 62.1 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.228 0.537 . . . . 0.0 110.865 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.439 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 78.7 m-20 -89.53 125.7 35.3 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.409 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -84.15 171.51 12.77 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.03 -51.78 16.54 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -70.1 -12.48 61.63 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.572 ' O ' ' HZ2' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -79.23 86.46 5.0 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.504 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -0.79 12.66 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -142.06 135.39 29.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.75 0.31 . . . . 0.0 111.559 -177.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.439 ' HA ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 t -69.2 138.4 54.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.252 0.548 . . . . 0.0 109.886 174.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HA ' HH21 ' A' ' 38' ' ' ARG . 0.8 OUTLIER -100.43 2.52 42.3 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.637 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -104.87 -58.88 1.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.317 -174.627 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 24.7 p -93.26 -61.24 1.61 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.192 0.52 . . . . 0.0 111.661 -171.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 36' ' ' CYS . . . -133.5 -86.0 0.27 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.879 -175.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.456 HH21 ' HA ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -175.73 -132.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.681 0.24 . . . . 0.0 111.188 -169.175 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.432 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.59 145.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.77 0.828 . . . . 0.0 113.187 -173.527 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -64.34 104.36 0.76 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.968 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.86 88.44 0.55 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.422 -179.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -135.66 101.86 4.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.027 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -132.11 68.32 0.55 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.963 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -89.68 -177.07 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.62 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.408 ' H ' HG13 ' A' ' 45' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.306 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 112.28 -0.328 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 112.94 25.03 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.703 0.287 . . . . 0.0 110.804 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -151.18 96.79 2.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.952 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m 58.1 39.02 26.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.694 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -133.02 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.424 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.57 155.11 18.04 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.761 0.315 . . . . 0.0 110.665 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.71 113.22 16.58 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.88 93.28 4.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.413 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.437 ' HA ' ' NE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -78.52 105.46 9.8 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 172.046 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.529 HG21 ' HB3' ' A' ' 14' ' ' ASP . 2.1 t -66.95 95.12 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.028 -176.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -15.58 61.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.398 0.618 . . . . 0.0 111.045 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -81.08 -32.4 33.94 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.349 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 118.24 96.6 1.8 Allowed Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.428 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.529 ' HB3' HG21 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -80.53 146.39 31.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.136 0.493 . . . . 0.0 110.039 178.227 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.475 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 8.8 p-90 -136.96 177.91 7.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.944 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.811 ' HB ' ' HA2' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -111.88 -108.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.155 -176.675 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.494 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.1 t -134.89 137.62 27.7 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.4 Cg_exo -62.55 -26.69 76.16 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.725 2.283 . . . . 0.0 112.395 -171.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HD3' ' A' ' 20' ' ' LYS . 6.8 t0 -147.1 178.03 8.7 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.554 ' HD3' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER 72.46 150.66 0.1 Allowed 'General case' 0 N--CA 1.432 -1.333 0 CA-C-O 122.123 0.963 . . . . 0.0 110.345 175.821 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 39.01 0.16 Allowed 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.527 172.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.479 ' H ' ' C ' ' A' ' 20' ' ' LYS . 14.2 t -77.2 -78.6 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.112 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.811 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 70.54 36.93 68.56 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.767 178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 4.8 t30 -70.73 131.2 43.5 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -77.73 99.28 2.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.476 0.655 . . . . 0.0 110.53 -177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -85.4 151.32 24.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.447 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -48.41 -80.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 O-C-N 123.816 0.697 . . . . 0.0 111.56 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -59.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.508 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 0.5 OUTLIER -83.52 52.28 2.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.873 178.748 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.58 ' NH2' ' HA ' ' A' ' 34' ' ' ASP . 0.1 OUTLIER -122.46 117.57 26.29 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.515 174.859 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -82.69 -3.72 56.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.931 0.396 . . . . 0.0 110.824 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 9.8 m -141.84 154.98 45.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.366 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.425 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.9 t -58.36 136.46 57.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.163 0.506 . . . . 0.0 110.693 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.58 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 12.3 t70 -72.63 -11.42 60.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.349 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -108.47 -57.77 2.09 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.989 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.466 ' SG ' ' NZ ' ' A' ' 20' ' ' LYS . 39.8 m -79.14 -37.8 37.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 111.904 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.425 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 85.54 11.45 74.7 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -171.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 133.06 36.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.4 OUTLIER -77.07 158.53 30.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.37 -174.801 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.98 78.7 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.904 172.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.71 106.49 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.709 -173.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 120.73 14.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.307 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -147.5 -80.76 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.768 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.22 -36.87 77.97 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 122.533 2.155 . . . . 0.0 111.143 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.461 ' HA ' HD13 ' A' ' 45' ' ' ILE . 1.8 mm . . . . . 0 C--O 1.25 1.086 0 CA-C-O 117.76 -1.114 . . . . 0.0 108.594 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.535 -0.626 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.83 103.17 3.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 0.0 111.019 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.486 ' H ' ' HG2' ' A' ' 3' ' ' MET . 0.6 OUTLIER -104.08 -12.2 16.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.827 179.793 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.18 91.1 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.933 0.397 . . . . 0.0 110.185 176.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.5 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -77.91 -106.91 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.188 179.442 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' H ' ' HB ' ' A' ' 5' ' ' THR . 4.2 mptt -100.8 48.65 0.9 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.067 0.46 . . . . 0.0 110.825 -176.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.65 121.45 17.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.771 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -81.12 59.18 3.77 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.867 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.564 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -81.51 70.28 8.34 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 172.842 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.564 ' HB ' ' O ' ' A' ' 9' ' ' ARG . 5.4 t 78.25 133.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.919 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.34 156.12 26.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.954 -176.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -72.21 -48.84 39.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.709 -175.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.504 ' O ' ' HA ' ' A' ' 28' ' ' ALA . . . -108.52 33.41 6.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.502 -172.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -64.87 152.86 41.9 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.524 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -129.74 -10.74 4.43 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.161 0.981 . . . . 0.0 109.904 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.524 ' HB ' ' O ' ' A' ' 15' ' ' TRP . 7.8 mm 71.11 138.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.444 0 CA-C-N 112.751 -2.022 . . . . 0.0 109.642 -172.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 24.7 t -42.66 146.44 0.73 Allowed Pre-proline 0 C--O 1.24 0.561 0 C-N-CA 122.832 0.453 . . . . 0.0 111.999 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.5 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -68.31 -13.78 38.62 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.42 2.08 . . . . 0.0 111.379 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -98.18 -178.72 4.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.948 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.1 11.48 11.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.014 0.435 . . . . 0.0 110.567 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -97.97 -24.07 15.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.779 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.644 ' SG ' ' HB3' ' A' ' 35' ' ' ARG . 59.5 m -97.06 -73.11 0.62 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.409 0.623 . . . . 0.0 111.454 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 16' ' ' ILE . . . 69.52 37.17 78.06 Favored Glycine 0 N--CA 1.44 -1.047 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 -166.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.96 137.77 58.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.534 -0.833 . . . . 0.0 111.568 -176.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -86.62 87.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.018 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.7 166.76 21.48 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.715 -173.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -65.27 -74.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 13' ' ' GLY . . . -179.09 -76.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.079 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 37.1 mmt-85 -77.45 42.79 0.36 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.067 -178.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.86 135.19 39.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 174.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 1.38 51.7 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.0 0.429 . . . . 0.0 110.504 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.98 155.63 41.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.591 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 40.7 t -67.78 155.1 40.07 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.5 176.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -17.57 17.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.373 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.644 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -88.19 -45.64 9.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.938 -178.323 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -113.45 -55.75 2.48 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.956 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.53 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 125.74 8.92 5.05 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.09 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -62.21 137.5 58.27 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -75.68 153.68 36.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.357 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -58.6 107.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.638 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -63.17 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.013 0.435 . . . . 0.0 111.482 -176.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.96 -42.76 0.27 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.3 0.571 . . . . 0.0 110.673 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 137.83 -71.85 0.45 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.07 -28.02 41.65 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.157 1.905 . . . . 0.0 110.465 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.881 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.342 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 112.184 -0.367 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.77 42.9 30.27 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.966 0.412 . . . . 0.0 111.794 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.08 -80.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.164 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.486 ' HB2' ' H ' ' A' ' 5' ' ' THR . 1.3 m 54.86 -100.67 0.11 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.694 -176.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.486 ' H ' ' HB2' ' A' ' 4' ' ' SER . 0.3 OUTLIER -111.99 1.9 16.64 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.197 0.522 . . . . 0.0 111.062 179.281 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.86 69.41 1.34 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.499 . . . . 0.0 110.506 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 149.59 22.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.178 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.427 ' HZ ' HG11 ' A' ' 25' ' ' VAL . 11.1 t80 59.55 77.45 0.31 Allowed 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.789 0.681 . . . . 0.0 111.865 176.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.591 HH22 ' HE1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -93.29 127.3 38.82 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.628 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -130.99 128.39 62.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -75.66 143.23 42.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.305 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.41 148.27 37.42 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.557 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 91.23 -11.98 70.54 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.306 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' A' ' 11' ' ' SER . 14.6 m-20 -71.32 161.79 30.5 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.507 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 23.5 p-90 -125.03 133.27 53.02 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.535 HG13 ' H ' ' A' ' 17' ' ' CYS . 0.9 OUTLIER -69.7 -55.51 14.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.703 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.535 ' H ' HG13 ' A' ' 16' ' ' ILE . 3.6 m -162.55 168.07 11.21 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.495 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 23.1 Cg_exo -64.74 -35.05 47.99 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.935 1.757 . . . . 0.0 111.19 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.707 ' HB3' ' HG2' ' A' ' 21' ' ' LYS . 29.8 t0 -155.17 163.4 40.25 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.116 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 31.78 0.16 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.937 0.399 . . . . 0.0 111.249 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.707 ' HG2' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -79.12 -38.98 34.8 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 173.341 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.65 -91.25 0.28 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.632 0.729 . . . . 0.0 109.408 170.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.48 64.69 0.45 Allowed Glycine 0 C--N 1.314 -0.685 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.717 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 51.4 t30 -105.8 -173.22 2.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.427 HG11 ' HZ ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -121.49 90.31 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.198 0.523 . . . . 0.0 109.676 174.148 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -95.3 167.49 11.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.519 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.691 ' HD2' ' HG2' ' A' ' 29' ' ' ARG . 3.9 t80 -102.22 144.05 31.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.955 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -51.11 -34.02 28.81 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.691 ' HG2' ' HD2' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -80.51 -3.84 51.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.944 0.402 . . . . 0.0 110.837 -179.208 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 15.9 mtt-85 -80.42 129.28 34.41 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.13 -12.73 40.24 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.295 0.569 . . . . 0.0 110.646 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.16 158.19 43.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.677 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' SG ' ' HD3' ' A' ' 18' ' ' PRO . 64.6 m -54.82 136.11 47.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.821 171.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.93 -41.9 18.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.894 0.378 . . . . 0.0 111.71 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -42.79 8.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.087 0.47 . . . . 0.0 110.745 -174.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.94 -57.45 3.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.854 -176.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.456 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 111.31 19.94 7.29 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.487 -0.863 . . . . 0.0 114.638 174.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -91.91 167.37 12.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.853 0.827 . . . . 0.0 109.089 173.049 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pm0 -96.39 151.86 19.14 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 121.93 -0.482 . . . . 0.0 110.624 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.4 68.9 2.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.149 0.5 . . . . 0.0 110.071 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -72.94 -30.63 64.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.767 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.48 107.0 4.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.347 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -137.19 -167.81 11.19 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -75.74 60.35 5.94 Favored 'Trans proline' 0 CA--C 1.53 0.285 0 C-N-CA 123.155 2.57 . . . . 0.0 112.162 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.6 mt . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.517 179.26 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 111.936 -0.466 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.19 86.92 1.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.131 0.491 . . . . 0.0 110.682 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.55 13.91 17.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.04 12.93 14.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.925 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.7 m 68.68 104.37 0.05 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.515 -175.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 115.13 2.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.876 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.08 164.1 16.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.239 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -65.73 92.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.234 0.54 . . . . 0.0 110.945 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.05 133.35 35.38 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.851 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.41 171.02 3.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.111 179.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.43 142.09 58.05 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.11 157.26 16.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.592 0.711 . . . . 0.0 111.172 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 98.95 -43.83 1.8 Allowed Glycine 0 C--N 1.314 -0.693 0 N-CA-C 110.038 -1.225 . . . . 0.0 110.038 -168.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 136.52 33.14 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.712 ' HH2' HH12 ' A' ' 38' ' ' ARG . 6.6 p-90 -127.17 149.48 49.95 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.145 0.498 . . . . 0.0 110.903 -177.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' HA ' ' A' ' 25' ' ' VAL . 3.8 pt -98.8 -117.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.72 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.543 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 5.5 t -123.2 149.88 58.58 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 175.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.543 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 46.4 Cg_exo -57.18 -29.99 85.56 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.989 1.792 . . . . 0.0 112.444 -177.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 20' ' ' LYS . 18.7 t70 -110.97 -174.94 2.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.976 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 5.3 mtmm -103.27 -9.95 19.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.161 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -60.41 -37.8 82.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.112 0.482 . . . . 0.0 110.265 177.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.555 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -88.02 -79.74 0.29 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.509 0.671 . . . . 0.0 110.317 174.593 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.48 27.37 73.55 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -170.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 32.7 t30 -84.19 133.61 34.59 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.014 -0.593 . . . . 0.0 110.677 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.458 ' HA ' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -78.16 92.29 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.482 0.658 . . . . 0.0 110.492 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 34' ' ' ASP . 91.4 m-20 -79.93 -172.88 3.6 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.413 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.798 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 2.2 t80 -73.75 -131.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.09 -62.99 0.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.95 41.61 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.241 175.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.798 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -111.01 121.48 45.47 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.459 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.69 21.3 8.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.604 0.716 . . . . 0.0 109.933 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.2 m -153.99 150.69 28.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.446 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.916 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -63.54 158.5 20.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.404 0.621 . . . . 0.0 111.8 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 0.5 OUTLIER -92.9 -18.75 22.4 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.391 174.607 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.555 ' NH2' ' HA ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -104.44 -68.26 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.678 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.726 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 29.5 p -79.91 -30.4 40.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.195 0.521 . . . . 0.0 110.259 -176.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.916 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 87.72 6.68 76.23 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.881 -0.676 . . . . 0.0 113.926 168.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.726 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -73.04 166.85 22.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.633 0.717 . . . . 0.0 110.051 177.127 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.485 ' O ' ' HD2' ' A' ' 38' ' ' ARG . 20.3 pm0 -74.25 175.69 7.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.515 -177.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -77.52 55.08 1.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.849 0.833 . . . . 0.0 110.555 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.55 117.51 25.37 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.393 178.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.26 20.0 12.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.466 0.65 . . . . 0.0 110.516 -179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.409 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -82.16 143.31 22.89 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.967 176.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.409 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 21.0 Cg_exo -65.83 99.9 0.41 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.811 2.341 . . . . 0.0 112.191 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.244 0.792 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.79 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -63.85 118.38 8.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.427 0.113 . . . . 0.0 110.857 -178.789 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 2' ' ' SER . 3.4 tmm? 73.1 -52.69 0.71 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.955 0.785 . . . . 0.0 111.546 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.03 78.72 7.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.018 0.437 . . . . 0.0 111.254 -178.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.36 6.63 13.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.003 0.43 . . . . 0.0 111.332 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -86.35 65.14 8.92 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 172.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -100.4 -153.33 0.44 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.537 -173.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.411 ' HB3' HG12 ' A' ' 10' ' ' VAL . 87.5 m-85 -87.64 120.26 28.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.941 -175.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 71.28 3.2 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.767 172.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.411 HG12 ' HB3' ' A' ' 8' ' ' PHE . 8.7 p -151.58 25.68 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.499 1.143 . . . . 0.0 108.709 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.434 ' HB2' ' H ' ' A' ' 12' ' ' ASP . 2.2 p -102.05 -139.06 0.34 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.599 -174.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.434 ' H ' ' HB2' ' A' ' 11' ' ' SER . 18.2 p-10 -83.95 154.55 23.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 170.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.16 -44.79 3.12 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -170.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.25 177.31 6.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.469 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 39.6 p-90 -160.98 148.43 15.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.705 0.288 . . . . 0.0 110.618 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -99.92 157.12 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 6.2 m -47.62 144.69 4.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 123.879 0.737 . . . . 0.0 111.916 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' H ' ' A' ' 41' ' ' THR . 11.8 Cg_exo -69.62 -31.59 20.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.551 2.167 . . . . 0.0 113.981 -164.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 20' ' ' LYS . 4.7 t70 -116.04 172.15 7.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.139 0.495 . . . . 0.0 111.551 -174.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -77.95 -25.45 48.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.993 -178.827 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.3 mmtm -71.24 -16.29 62.49 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.485 0.66 . . . . 0.0 110.005 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 1.2 m -97.2 -85.81 0.35 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.55 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.01 14.24 67.86 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.177 -0.919 . . . . 0.0 113.65 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.764 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 2.4 t-20 -80.23 153.65 28.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.939 0.399 . . . . 0.0 111.219 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -93.33 106.71 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.512 . . . . 0.0 110.07 174.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.593 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -87.95 176.36 7.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.029 -174.675 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -61.89 -89.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.401 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -65.14 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.539 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 3.0 mmt-85 -78.66 56.46 1.85 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.173 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.8 mmt-85 -126.43 129.93 49.7 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.599 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.71 -3.21 42.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.488 0.661 . . . . 0.0 109.864 172.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -130.98 166.41 21.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.491 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.695 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 85.2 m -56.9 169.48 0.51 Allowed 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.97 0.891 . . . . 0.0 113.176 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 26' ' ' ASN . 3.2 t70 -99.68 -41.35 7.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.44 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.582 ' HG2' ' ND2' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -105.78 -48.01 3.74 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.357 -177.508 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.27 -43.26 42.51 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -171.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.695 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 90.84 37.7 6.32 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.322 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -100.63 170.45 8.36 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.012 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -91.26 149.47 21.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -57.28 102.32 0.09 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.118 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.562 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -68.06 105.23 1.98 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.932 177.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.23 106.63 6.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.177 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 154.39 -74.01 0.24 Allowed Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.731 -176.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.98 138.69 37.68 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.933 2.422 . . . . 0.0 111.849 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.1 tp . . . . . 0 C--O 1.251 1.17 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.897 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 112.217 -0.353 . . . . 0.0 112.217 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.623 ' HA ' HG22 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -71.36 -45.48 62.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.657 0.265 . . . . 0.0 111.525 -178.622 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.65 -73.06 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.96 142.57 27.15 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.29 23.97 0.27 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -174.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -99.44 106.9 19.0 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -99.97 166.4 11.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.596 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -78.23 80.7 4.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.28 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -97.77 121.3 39.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.61 175.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.51 HG12 ' H ' ' A' ' 12' ' ' ASP . 10.9 t -62.5 128.7 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.961 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -13.14 58.1 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.419 0.628 . . . . 0.0 111.724 -176.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.51 ' H ' HG12 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -74.92 -19.92 59.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.31 177.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 112.96 -12.34 24.61 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.171 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -82.46 168.24 17.63 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.022 0.439 . . . . 0.0 111.171 -177.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.591 ' HH2' HH12 ' A' ' 38' ' ' ARG . 13.5 p-90 -130.36 171.56 12.81 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -112.16 -101.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.417 -176.593 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' NH2' ' A' ' 38' ' ' ARG . 6.5 t -146.1 148.2 34.43 Favored Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.0 Cg_exo -62.03 -28.08 80.04 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.113 1.875 . . . . 0.0 111.981 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.73 176.94 7.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.661 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 -14.16 12.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.137 -176.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -26.87 37.04 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.941 0.401 . . . . 0.0 110.171 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.28 -78.44 0.17 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.02 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.25 23.78 74.83 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.943 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 19.2 t-20 -65.91 135.47 54.81 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 122.161 0.184 . . . . 0.0 110.579 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -78.5 96.63 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.545 0.688 . . . . 0.0 109.811 176.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.763 HD21 ' HA ' ' A' ' 33' ' ' CYS . 5.3 m-80 -83.28 -174.46 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.126 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -76.64 -135.59 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.612 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -134.03 -50.46 0.82 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -87.56 13.4 10.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.907 175.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.96 125.79 29.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.023 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.89 -8.92 48.06 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.034 0.445 . . . . 0.0 110.507 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.2 149.33 50.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.808 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.763 ' HA ' HD21 ' A' ' 26' ' ' ASN . 2.9 t -62.59 160.62 13.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.028 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -100.76 -26.15 13.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.78 -64.98 1.03 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.079 -176.172 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 21.5 p -80.58 -40.07 26.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.596 -176.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.65 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.48 7.95 47.57 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.679 -0.772 . . . . 0.0 114.153 169.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.732 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -79.32 169.69 17.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.294 0.547 . . . . 0.0 110.941 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -90.05 155.84 18.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.89 0.376 . . . . 0.0 110.791 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -76.72 107.44 9.03 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.853 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.18 -35.15 79.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.845 178.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 63.92 53.91 1.83 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.992 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -106.09 114.46 4.48 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.01 -33.52 19.23 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.348 2.032 . . . . 0.0 112.632 -177.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.623 HG22 ' HA ' ' A' ' 2' ' ' SER . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.454 -176.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.583 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 88.35 4.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.967 0.413 . . . . 0.0 110.706 178.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.91 -62.57 1.29 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.513 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.39 29.16 3.01 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.235 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.59 118.13 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.505 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.45 179.58 4.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.1 175.678 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -83.31 174.32 10.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 0.0 110.439 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -81.75 9.37 8.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.599 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.88 131.97 47.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.948 0.404 . . . . 0.0 110.059 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 t -80.77 132.7 31.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.087 0.47 . . . . 0.0 110.487 -176.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.58 154.69 19.79 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.629 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.56 141.01 29.2 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 87.86 23.43 38.73 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -171.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 14.5 p-10 -94.45 -172.81 2.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.292 -0.954 . . . . 0.0 111.511 -175.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CD2' ' HE2' ' A' ' 40' ' ' LYS . 12.1 p-90 -155.59 171.79 19.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.411 177.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.74 153.43 14.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 171.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.843 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 92.7 m -42.03 146.14 0.67 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.372 1.045 . . . . 0.0 112.516 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HA ' HG23 ' A' ' 42' ' ' THR . 31.4 Cg_exo -58.7 -28.04 85.21 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.94 2.427 . . . . 0.0 113.707 -172.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -121.24 177.17 5.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.162 0.506 . . . . 0.0 111.578 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.35 -27.43 19.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.185 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -70.32 -24.34 62.99 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -80.56 -82.43 0.12 Allowed 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.492 171.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.96 47.66 59.36 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.353 -0.84 . . . . 0.0 114.913 174.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.843 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 3.3 t30 -105.66 155.61 19.07 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 117.075 0.438 . . . . 0.0 110.847 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.422 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -85.2 110.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.916 173.635 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -88.69 160.78 17.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.401 -177.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -51.72 -76.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.652 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 179.67 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.711 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.22 51.88 1.89 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.228 0.537 . . . . 0.0 110.381 179.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -108.31 128.49 54.79 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.419 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.97 7.22 43.15 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.963 0.411 . . . . 0.0 110.913 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.77 156.27 44.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.726 177.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 153.69 11.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 175.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.86 -7.93 23.07 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -169.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.89 -36.89 0.2 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -172.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.55 -29.4 3.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -160.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.72 -109.73 2.1 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.196 -1.002 . . . . 0.0 113.514 -170.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.423 ' HB3' ' H ' ' A' ' 39' ' ' GLU . 2.9 mmt180 -171.19 -156.56 0.12 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.391 0.139 . . . . 0.0 110.979 -171.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.423 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.9 148.63 0.52 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.457 ' HE2' ' CD2' ' A' ' 15' ' ' TRP . 35.0 tttm -59.59 92.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.945 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -5.21 59.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.305 -178.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.452 HG23 ' HA ' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -80.6 -11.6 59.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.0 178.423 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 89.43 -149.78 20.85 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.527 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -74.86 -155.16 0.04 OUTLIER 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.178 2.586 . . . . 0.0 112.024 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.8 mm . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.129 -0.939 . . . . 0.0 109.619 176.847 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.93 4.49 47.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.004 0.43 . . . . 0.0 111.243 -178.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.04 59.42 5.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.117 0.484 . . . . 0.0 110.802 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.62 -63.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.468 176.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.63 73.76 2.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.118 0.485 . . . . 0.0 110.636 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.91 21.21 14.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.384 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -80.84 -34.4 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.13 -175.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.3 109.11 20.97 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.711 -177.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.58 36.12 1.01 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.62 0.724 . . . . 0.0 109.465 176.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -143.24 168.28 12.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.723 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.8 -168.34 0.45 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -176.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.7 -55.98 5.98 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.301 -173.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -87.58 -6.52 76.98 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.111 -176.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.69 159.86 27.78 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.558 ' CE2' ' HG3' ' A' ' 40' ' ' LYS . 12.5 p-90 -161.07 164.18 30.97 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.983 0.421 . . . . 0.0 111.213 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pt -115.31 159.53 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 36.8 t -46.28 141.0 5.03 Favored Pre-proline 0 C--O 1.236 0.373 0 O-C-N 123.744 0.653 . . . . 0.0 111.669 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.557 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 7.6 Cg_exo -76.79 -10.56 18.37 Favored 'Trans proline' 0 N--CA 1.446 -1.299 0 C-N-CA 122.02 1.813 . . . . 0.0 111.435 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -106.46 160.64 15.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.653 -174.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -96.25 20.05 10.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.236 -176.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 -35.75 12.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.065 0.459 . . . . 0.0 109.8 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.1 m -99.28 -79.26 0.49 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.526 0.679 . . . . 0.0 111.475 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.73 21.72 76.23 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 -165.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -64.41 144.43 57.17 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 113.507 -1.347 . . . . 0.0 110.525 -176.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.64 99.14 8.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.375 0.607 . . . . 0.0 109.8 174.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.55 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 3.5 m120 -78.7 163.2 25.62 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.816 -176.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.28 -85.24 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.556 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.412 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . 179.98 -58.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.428 ' HA ' ' HD2' ' A' ' 29' ' ' ARG . 7.4 mmm180 -78.11 31.74 0.18 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.62 175.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' H ' ' C ' ' A' ' 28' ' ' ALA . 63.6 mmt-85 -98.53 121.35 40.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.225 -176.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.69 -5.55 51.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.118 0.485 . . . . 0.0 110.435 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.1 m -142.82 168.1 20.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.331 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.841 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 17.2 t -63.06 156.93 23.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.593 0.711 . . . . 0.0 111.585 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -96.11 -9.78 29.91 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.142 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -110.89 -59.85 1.91 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.829 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.0 p -94.52 -55.12 3.26 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.192 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.841 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.71 9.03 4.08 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.505 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -64.19 149.78 47.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.927 0.364 . . . . 0.0 110.439 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.43 155.74 37.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.615 0.245 . . . . 0.0 111.003 -175.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.558 ' HG3' ' CE2' ' A' ' 15' ' ' TRP . 17.4 tttm -64.17 90.39 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.501 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.03 47.03 1.45 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.338 -176.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.423 ' OG1' ' HG2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -85.36 56.97 4.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.78 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -138.43 -103.97 0.62 Allowed Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -87.67 110.49 0.72 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.551 2.167 . . . . 0.0 111.42 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.301 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.2 70.92 10.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.053 0.454 . . . . 0.0 110.601 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.8 ttp -83.71 64.87 8.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 110.37 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.09 179.47 4.26 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.404 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 12.3 t -147.45 -166.2 2.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.01 68.41 10.05 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 177.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -51.34 112.65 0.78 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.426 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.48 178.98 2.69 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.552 0.691 . . . . 0.0 110.888 -176.318 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.79 45.11 1.12 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.137 -177.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.502 HG22 ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -120.28 12.55 6.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 178.708 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.08 50.47 1.09 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.439 0.638 . . . . 0.0 111.082 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.37 -143.57 0.06 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.008 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -86.44 10.89 65.17 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.68 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . 4.2 m-20 -95.01 -172.63 2.74 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.528 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 6.4 p-90 -145.66 153.84 41.45 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.8 -80.02 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 4.6 m -149.92 151.67 32.75 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.647 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 10.0 Cg_exo -75.18 -17.9 18.78 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.82 2.347 . . . . 0.0 112.433 -175.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 22' ' ' CYS . 42.5 t0 -122.82 162.63 21.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.95 -170.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -15.97 32.76 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 175.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -90.55 6.58 43.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.668 174.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -98.24 -89.53 0.3 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.05 179.099 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.476 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 72.38 55.7 6.69 Favored Glycine 0 CA--C 1.521 0.451 0 CA-C-N 115.18 -0.918 . . . . 0.0 114.35 173.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.611 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 15.7 t-20 -123.79 167.64 13.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 173.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.0 104.63 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.965 0.412 . . . . 0.0 110.142 176.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -102.05 178.6 4.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.117 0.484 . . . . 0.0 111.628 -174.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.457 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -100.88 135.77 41.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.106 177.0 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB2' ' HA ' ' A' ' 14' ' ' ASP . . . -47.05 -51.59 17.09 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.213 0.605 . . . . 0.0 112.605 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 29' ' ' ARG . 4.1 ptt180 -69.74 -16.13 63.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.541 -177.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.2 mmt180 -74.36 133.98 42.49 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.8 2.22 40.95 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.933 0.397 . . . . 0.0 110.651 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -133.76 150.16 51.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.351 -178.696 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.54 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 34.0 m -70.04 145.48 51.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.927 175.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -83.97 -45.37 13.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.642 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 9.2 mmt180 -91.73 -48.46 6.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.049 0.452 . . . . 0.0 111.498 -174.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -45.36 24.67 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.203 -173.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.59 23.01 14.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.798 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.54 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -96.0 -164.04 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.643 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.496 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.0 mp0 -125.26 158.48 33.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -72.47 74.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.106 0.479 . . . . 0.0 110.869 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 p -78.84 -63.7 1.35 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.289 0.566 . . . . 0.0 110.362 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.449 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -102.3 110.69 22.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.018 -179.024 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.45 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -142.16 121.9 1.89 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 121.152 -0.547 . . . . 0.0 111.886 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.45 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 5.8 Cg_exo -78.97 61.79 8.26 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.039 2.493 . . . . 0.0 112.288 -178.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 35.9 mt . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.124 179.007 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.27 -24.32 14.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.668 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ttp -105.52 111.17 23.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.812 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.67 118.67 33.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 173.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.6 m 68.94 127.39 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.689 0.618 . . . . 0.0 110.342 -170.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 108.85 0.74 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.979 0.419 . . . . 0.0 111.101 -177.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 p30 -97.89 17.9 17.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.179 0.514 . . . . 0.0 110.536 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.31 71.79 3.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.296 178.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.81 77.73 2.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.457 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 p -61.66 103.14 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.702 0.763 . . . . 0.0 109.877 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.28 164.05 20.32 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.54 -175.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.6 155.76 25.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 0.0 110.546 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.2 15.63 60.39 Favored Glycine 0 C--N 1.318 -0.455 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 -168.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -83.09 174.33 10.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.897 -1.152 . . . . 0.0 111.686 -175.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.509 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 24.1 p-90 -160.09 153.94 22.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.325 173.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.08 156.48 8.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.426 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . 3.7 t -43.85 143.72 1.64 Allowed Pre-proline 0 C--O 1.235 0.329 0 O-C-N 123.778 0.674 . . . . 0.0 111.124 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.509 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.6 Cg_exo -63.55 -20.44 69.53 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.376 2.051 . . . . 0.0 112.278 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -111.65 149.58 31.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.449 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.22 -1.74 50.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.392 -174.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -76.29 -15.29 60.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.402 0.62 . . . . 0.0 110.053 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB2' HH21 ' A' ' 38' ' ' ARG . 0.1 OUTLIER -110.3 -82.39 0.57 Allowed 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.705 178.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.75 17.68 80.06 Favored Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.294 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.839 ' HB2' ' HD3' ' A' ' 35' ' ' ARG . 29.0 t-20 -62.59 134.7 56.75 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -80.05 90.24 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.674 0.75 . . . . 0.0 110.363 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -79.61 112.93 17.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.917 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -19.52 -79.5 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.102 1.501 . . . . 0.0 113.997 -175.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -176.5 -64.73 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.08 41.35 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.519 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.6 mmt-85 -108.82 104.89 14.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.575 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.92 -10.91 59.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.271 0.557 . . . . 0.0 111.187 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -141.38 146.71 36.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.796 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 31.0 t -56.99 145.66 29.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.008 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -89.11 -15.96 32.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.175 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.839 ' HD3' ' HB2' ' A' ' 24' ' ' ASN . 3.6 ttp180 -95.15 -44.01 7.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.417 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.585 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 15.3 p -127.31 -26.31 3.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.796 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 100.25 14.38 33.36 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.555 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.76 HH21 ' HB2' ' A' ' 22' ' ' CYS . 2.9 tpp180 -60.92 143.81 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.862 0.363 . . . . 0.0 110.693 176.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.44 155.71 39.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -72.59 67.3 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.975 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.3 129.26 42.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.785 178.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.66 124.24 42.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.816 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 139.24 -157.09 24.84 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.295 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -62.58 107.92 0.66 Allowed 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.144 2.563 . . . . 0.0 112.803 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.245 0.851 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.385 175.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.799 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.15 -164.72 1.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.78 102.98 0.82 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.676 0.274 . . . . 0.0 110.407 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.81 20.39 7.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.209 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m 60.55 44.02 12.19 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.53 -177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.6 39.21 1.03 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.833 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -87.24 95.95 10.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.425 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.3 t80 50.23 51.3 17.01 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.729 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.414 ' HA ' HH11 ' A' ' 9' ' ' ARG . 0.0 OUTLIER -81.54 93.38 6.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.481 -175.959 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -89.86 104.55 15.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 171.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.8 -167.18 1.54 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.309 0.576 . . . . 0.0 112.001 -172.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -72.98 -46.68 50.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.816 -174.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -94.83 12.94 68.02 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.611 -175.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -76.12 163.06 27.48 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 0.0 110.19 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.481 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 1.1 p-90 -133.35 -167.06 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.266 -170.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.6 OUTLIER -122.36 -60.17 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 47.6 t -177.9 155.31 1.03 Allowed Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.635 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 23.1 Cg_exo -66.28 -13.48 40.04 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.967 1.778 . . . . 0.0 111.902 172.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -101.68 -173.61 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.794 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -6.56 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.628 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -93.47 2.9 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.221 0.534 . . . . 0.0 110.012 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.488 ' HA ' HH21 ' A' ' 35' ' ' ARG . 5.8 t -104.21 -81.62 0.52 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.355 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.87 50.77 17.38 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.497 -0.858 . . . . 0.0 110.978 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.498 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 18.5 t-20 -81.08 177.3 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.28 -0.46 . . . . 0.0 109.837 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.49 91.38 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.221 0.534 . . . . 0.0 110.204 175.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.778 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.78 151.97 25.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.284 0.564 . . . . 0.0 110.568 -179.151 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 1.9 t80 -81.64 148.03 29.25 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.134 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -43.26 -42.52 4.42 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.844 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -78.28 2.84 17.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.854 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.8 mmm180 -97.3 118.3 33.45 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 175.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -5.67 59.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.612 -177.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -140.62 159.94 41.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.478 -178.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HA ' HD22 ' A' ' 26' ' ' ASN . 53.2 t -60.74 144.24 52.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.971 0.415 . . . . 0.0 109.901 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.82 -8.42 58.81 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.488 HH21 ' HA ' ' A' ' 22' ' ' CYS . 0.3 OUTLIER -106.67 -52.84 2.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.171 178.801 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 86.1 m -78.73 -39.24 36.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.674 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.68 9.98 85.74 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.625 -0.797 . . . . 0.0 111.55 -175.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -88.94 143.12 27.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -70.66 156.2 39.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.377 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.39 110.16 1.36 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.711 173.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.79 -27.43 66.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.0 m -118.3 89.97 3.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.497 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.501 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -112.85 123.13 6.11 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.137 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.501 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 2.1 Cg_endo -81.71 66.64 8.49 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.44 2.76 . . . . 0.0 111.653 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.483 ' H ' HG13 ' A' ' 45' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.799 0 CA-C-O 118.597 -0.716 . . . . 0.0 110.372 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.823 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.531 ' HB2' ' H ' ' A' ' 3' ' ' MET . 0.4 OUTLIER 49.06 -106.66 0.2 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.297 0.639 . . . . 0.0 112.005 179.487 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.531 ' H ' ' HB2' ' A' ' 2' ' ' SER . 0.0 OUTLIER -123.14 146.09 48.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.728 0.299 . . . . 0.0 110.483 -179.197 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 49.28 1.77 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.064 -178.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.56 -56.54 9.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.918 0.389 . . . . 0.0 111.535 -177.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.67 25.48 3.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.049 0.452 . . . . 0.0 110.69 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -78.47 -23.49 46.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.527 0.679 . . . . 0.0 110.139 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.603 ' HE1' HG11 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -135.93 -160.47 1.06 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.179 177.357 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.447 ' HG3' ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -101.25 122.4 43.59 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.953 179.376 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 t -87.34 81.41 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 171.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -82.63 -136.05 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.343 -171.191 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.453 ' H ' ' HB2' ' A' ' 11' ' ' SER . 0.4 OUTLIER -74.38 -68.17 0.55 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.999 -171.583 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.556 ' O ' ' HA ' ' A' ' 28' ' ' ALA . . . -82.95 -11.99 80.42 Favored Glycine 0 C--O 1.225 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.787 -173.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.55 101.37 1.6 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.858 0.361 . . . . 0.0 110.217 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.696 ' CZ3' ' HG3' ' A' ' 40' ' ' LYS . 50.9 p-90 -107.85 165.87 11.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.463 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.521 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.1 pp -106.32 150.48 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.762 175.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 56.7 m -41.09 150.42 0.31 Allowed Pre-proline 0 CA--C 1.537 0.447 0 O-C-N 124.45 1.094 . . . . 0.0 113.314 -177.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.974 ' HG3' ' HA ' ' A' ' 40' ' ' LYS . 34.3 Cg_exo -59.25 -31.12 94.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 123.368 2.712 . . . . 0.0 113.822 -174.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -114.91 167.88 10.4 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.015 0.436 . . . . 0.0 111.462 -173.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.85 -36.42 49.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.485 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -30.23 71.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.685 175.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -76.94 -83.72 0.07 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.852 177.825 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.481 ' N ' ' HB2' ' A' ' 17' ' ' CYS . . . 51.75 40.22 48.43 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.2 -0.909 . . . . 0.0 114.559 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.848 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 5.3 t30 -100.47 158.22 16.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 117.218 0.509 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.603 HG11 ' HE1' ' A' ' 8' ' ' PHE . 0.8 OUTLIER -87.25 120.82 37.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.239 0.542 . . . . 0.0 110.579 177.5 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.31 177.47 4.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.545 -177.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.832 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 19.6 t80 -62.67 -93.38 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.702 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 13' ' ' GLY . . . -163.42 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.48 42.22 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.519 0.676 . . . . 0.0 110.591 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.832 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -92.11 138.99 31.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.761 177.038 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -31.7 18.55 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.728 0.299 . . . . 0.0 110.845 177.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.765 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -114.74 159.15 20.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.085 0.469 . . . . 0.0 112.07 -175.365 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -59.63 159.08 8.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.022 175.964 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.39 -21.54 17.12 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.876 -170.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -142.71 -30.73 0.53 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.35 -16.34 2.75 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -158.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' SG ' ' A' ' 33' ' ' CYS . . . -139.96 -112.61 1.01 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 119.28 -1.438 . . . . 0.0 114.596 -172.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.95 -160.03 0.77 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.669 -0.265 . . . . 0.0 110.61 -167.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.765 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.7 mt-10 -64.51 149.5 48.52 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.974 ' HA ' ' HG3' ' A' ' 18' ' ' PRO . 1.7 tttm -65.49 107.46 1.69 Allowed 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.795 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.498 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 2.8 p -80.99 162.12 23.98 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.125 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.02 106.35 18.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.884 174.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.55 -143.42 8.35 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.516 -176.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.74 -5.68 14.84 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 123.102 2.535 . . . . 0.0 112.194 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.861 -0.59 . . . . 0.0 109.991 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.923 0 N-CA-C 111.944 -0.462 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.37 90.01 7.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.702 0.287 . . . . 0.0 111.275 -175.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.77 20.76 12.22 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.969 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.96 -52.39 4.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.117 0.484 . . . . 0.0 110.597 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.87 141.76 35.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.565 178.502 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 6' ' ' LYS . 5.3 mmtt -100.71 154.74 18.36 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.449 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.81 131.91 46.47 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.564 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.429 ' HB2' ' H ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -148.81 -158.54 0.93 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 176.247 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' H ' ' HB2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -100.29 85.39 2.98 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.102 0.477 . . . . 0.0 110.202 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 p -119.87 135.83 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.354 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.8 m -98.39 75.43 2.23 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.854 0.835 . . . . 0.0 110.045 175.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -102.57 -121.45 0.18 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.707 -176.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.65 30.2 10.47 Favored Glycine 0 CA--C 1.508 -0.406 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -80.86 -169.01 2.0 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.464 -0.868 . . . . 0.0 111.521 -176.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.508 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p-90 -151.02 167.4 27.76 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -122.1 148.65 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 24' ' ' ASN . 4.0 m -39.61 141.67 0.7 Allowed Pre-proline 0 C--O 1.239 0.543 0 O-C-N 124.27 0.981 . . . . 0.0 113.095 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.508 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 31.2 Cg_exo -61.21 -25.04 80.15 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.426 2.084 . . . . 0.0 111.818 -176.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 21' ' ' LYS . 12.2 t70 -112.47 123.67 50.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.827 178.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.04 11.45 2.73 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -170.067 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -76.51 -30.05 57.04 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.28 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.8 ' HA ' HH21 ' A' ' 35' ' ' ARG . 53.2 t -96.31 -70.03 0.73 Allowed 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.11 52.07 53.59 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.469 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 t30 -87.41 150.7 23.62 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.094 -177.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.88 88.08 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.183 0.516 . . . . 0.0 110.112 177.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.533 ' ND2' ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -79.25 118.45 21.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.628 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -18.63 -82.49 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 O-C-N 125.13 1.518 . . . . 0.0 113.918 -170.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.45 -50.26 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.28 23.63 2.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.632 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 32' ' ' SER . 0.6 OUTLIER -96.58 115.54 27.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.446 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.94 -1.35 52.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 175.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -145.42 163.98 32.94 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.551 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 1.002 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 25.2 t -64.58 167.97 6.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.81 0.814 . . . . 0.0 112.018 175.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.0 -4.87 26.67 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.547 170.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.8 HH21 ' HA ' ' A' ' 22' ' ' CYS . 1.0 OUTLIER -123.95 -66.72 0.97 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.871 -177.434 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 25.9 p -80.0 -23.49 41.51 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.064 0.459 . . . . 0.0 110.636 -175.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 1.002 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 78.0 7.56 87.53 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.406 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.512 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -66.58 140.01 57.93 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.85 143.2 32.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.262 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -63.32 96.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.701 -178.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.83 115.02 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.642 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.91 115.76 30.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -173.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.415 ' HA3' ' HD3' ' A' ' 44' ' ' PRO . . . -174.08 -94.9 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.278 -0.729 . . . . 0.0 111.278 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.415 ' HD3' ' HA3' ' A' ' 43' ' ' GLY . 12.4 Cg_exo -71.28 -21.18 27.1 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.845 2.363 . . . . 0.0 111.084 172.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.264 0 CA-C-O 117.601 -1.19 . . . . 0.0 108.627 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.85 0 N-CA-C 112.312 -0.315 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.95 129.67 53.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.87 47.56 23.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.092 0.472 . . . . 0.0 111.069 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.54 102.35 3.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.522 -178.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.522 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -81.12 -105.48 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.522 ' H ' ' HB ' ' A' ' 5' ' ' THR . 6.1 mttt -101.27 166.58 10.69 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -91.11 83.54 5.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 0.0 109.797 176.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.55 39.94 0.97 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.098 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' HA ' ' NE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -85.8 73.58 10.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.088 0.47 . . . . 0.0 110.222 179.266 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.5 t -78.56 105.79 8.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.08 171.35 12.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.889 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -81.69 144.83 30.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 174.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 94.99 -33.84 5.15 Favored Glycine 0 C--N 1.312 -0.788 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -171.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.33 146.08 54.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.483 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 14.1 p-90 -152.09 154.18 35.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.096 0.474 . . . . 0.0 111.134 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -109.96 160.71 8.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.485 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 9.2 t -45.99 144.24 3.0 Favored Pre-proline 0 N--CA 1.463 0.192 0 O-C-N 123.809 0.693 . . . . 0.0 111.12 -178.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.485 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 18.9 Cg_exo -66.56 -2.63 7.71 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.41 2.074 . . . . 0.0 112.464 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -112.33 163.98 13.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.977 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.81 -21.39 16.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.993 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HG2' ' N ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -68.86 -29.53 67.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.361 0.6 . . . . 0.0 110.007 177.688 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.444 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -90.18 -83.01 0.26 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.102 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.21 35.28 64.03 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -175.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -67.43 144.29 55.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.325 -0.437 . . . . 0.0 110.136 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.83 87.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.602 0.715 . . . . 0.0 111.021 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.448 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -79.82 118.54 21.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.463 178.271 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -34.81 -75.13 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 124.125 0.891 . . . . 0.0 112.697 -177.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 176.69 -47.67 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -174.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.723 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -88.88 77.09 7.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 175.797 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 30' ' ' ARG . 2.0 mmt85 -151.79 117.88 5.55 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.13 -1.395 . . . . 0.0 108.688 -176.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -96.33 -7.41 35.33 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.276 0.56 . . . . 0.0 110.667 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -147.41 173.03 13.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.503 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.823 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 8.0 t -65.82 154.43 39.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.278 0.561 . . . . 0.0 111.564 176.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.53 -9.34 22.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.172 173.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -101.0 -69.4 0.78 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.077 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 28.5 p -91.21 -34.88 14.81 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.059 -174.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.823 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 105.39 7.25 37.66 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.28 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.465 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -57.95 140.53 51.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.027 0.441 . . . . 0.0 110.711 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.0 pm0 -72.75 171.11 13.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.844 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -76.33 58.92 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.242 0.544 . . . . 0.0 109.898 176.544 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 135.78 37.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.287 -177.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.8 -42.53 21.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.705 -179.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -120.51 124.39 5.88 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 178.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.01 127.6 25.66 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.07 2.514 . . . . 0.0 112.839 -178.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.9 mp . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.827 179.579 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.696 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.06 106.28 18.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.896 0.379 . . . . 0.0 110.338 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.18 139.31 22.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.262 -179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.74 124.72 25.41 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.425 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -27.05 68.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.745 -178.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -73.06 -54.4 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.013 0.435 . . . . 0.0 110.575 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -91.82 66.64 5.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.996 -176.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -86.71 51.82 2.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.732 176.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 68.32 10.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.634 -174.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.1 121.96 18.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 172.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.27 -136.96 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.318 0.58 . . . . 0.0 112.162 -169.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.95 -37.29 8.71 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.025 -178.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.13 -6.21 52.04 Favored Glycine 0 CA--C 1.521 0.437 0 CA-C-N 115.049 -0.978 . . . . 0.0 113.977 -176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -99.35 -175.45 3.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.096 0.448 . . . . 0.0 110.188 178.394 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.518 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 29.2 p-90 -160.39 157.26 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.624 0.25 . . . . 0.0 110.716 -176.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.8 pt -102.23 158.26 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 5.8 t -45.68 144.21 2.72 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 123.554 0.534 . . . . 0.0 111.806 -177.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 12.5 Cg_exo -72.67 1.52 6.24 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.023 2.482 . . . . 0.0 112.297 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.87 160.16 33.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.663 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -89.28 -19.93 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.831 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.703 ' HB2' HH22 ' A' ' 38' ' ' ARG . 31.3 mttt -62.42 -22.53 66.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.132 0.491 . . . . 0.0 110.874 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -86.35 0.42 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.427 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.4 26.3 57.45 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.371 -174.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 7.8 t30 -80.02 134.86 36.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.591 -0.305 . . . . 0.0 110.924 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.66 114.78 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.976 0.417 . . . . 0.0 109.885 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.42 158.11 17.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.499 ' O ' ' HB3' ' A' ' 14' ' ' ASP . 35.2 t80 -53.3 -77.7 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 O-C-N 123.572 0.545 . . . . 0.0 112.055 -175.114 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -178.34 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.122 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -71.39 24.37 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.774 177.336 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 32' ' ' SER . 11.7 mmt-85 -90.51 122.55 33.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.174 -177.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 -17.52 24.39 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.355 0.598 . . . . 0.0 109.631 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 50.8 m -132.35 168.41 18.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.397 174.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.484 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -64.0 164.51 10.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.937 0.875 . . . . 0.0 113.112 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -101.0 -24.69 14.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.213 170.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.58 -58.38 2.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.509 -171.292 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.516 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 31.2 p -93.65 -57.16 2.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.948 0.404 . . . . 0.0 110.753 -175.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.484 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.94 0.28 6.55 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.739 -178.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.703 HH22 ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.97 142.57 55.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.0 pm0 -87.63 172.87 9.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.416 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.66 67.86 0.8 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.858 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.3 t -80.32 -34.65 36.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.635 -175.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -60.97 1.95 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 0.0 110.722 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 152.26 -136.18 5.31 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.741 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -84.8 0.98 8.81 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.726 2.284 . . . . 0.0 112.331 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--O 1.25 1.083 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.631 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 112.255 -0.338 . . . . 0.0 112.255 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.525 ' O ' ' HB2' ' A' ' 3' ' ' MET . 0.0 OUTLIER -84.38 162.83 19.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.09 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.525 ' HB2' ' O ' ' A' ' 2' ' ' SER . 0.0 OUTLIER 79.67 -30.03 0.14 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.782 0.833 . . . . 0.0 112.025 176.854 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 106.35 3.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.374 178.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.25 107.88 18.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.709 178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -20.87 22.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.872 0.368 . . . . 0.0 110.575 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.34 131.05 36.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.053 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.15 101.68 1.9 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 178.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.16 78.82 1.77 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.434 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.96 102.5 3.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -80.46 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.604 0.716 . . . . 0.0 110.544 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -102.28 -149.53 0.39 Allowed 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.259 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.59 -123.06 4.78 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 111.278 -0.729 . . . . 0.0 111.278 -178.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.679 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 7.9 t70 -85.73 -62.29 1.56 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.635 0.731 . . . . 0.0 109.978 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.465 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 7.5 p-90 -160.16 161.24 33.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.743 -178.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -108.41 -75.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.781 177.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 1.5 m -147.53 152.67 42.35 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.736 ' HB3' HG22 ' A' ' 41' ' ' THR . 17.4 Cg_exo -68.87 -30.01 27.36 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.036 2.491 . . . . 0.0 113.425 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -127.9 -175.2 3.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.054 0.454 . . . . 0.0 111.867 -173.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -93.13 -29.92 15.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.841 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -4.06 33.85 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.742 174.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -88.38 -85.33 0.19 Allowed 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.752 175.828 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.65 75.36 Favored Glycine 0 CA--C 1.518 0.253 0 CA-C-N 114.761 -1.109 . . . . 0.0 114.256 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 21.4 t-20 -92.41 158.03 16.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.06 94.46 4.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.482 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -93.18 164.42 13.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.928 0.394 . . . . 0.0 110.613 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.453 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 t80 -83.91 -92.58 0.08 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.469 -173.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.679 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . . . -166.09 -62.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.247 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -81.01 21.61 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.221 0.534 . . . . 0.0 110.599 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 6.0 mtp85 -90.89 114.7 27.22 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.065 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.92 -0.67 57.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.264 0.554 . . . . 0.0 110.634 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -146.15 153.75 41.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.118 177.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.468 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 88.4 m -59.13 143.43 48.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.598 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -75.1 -37.66 61.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.995 176.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.459 ' HB2' ' ND2' ' A' ' 24' ' ' ASN . 0.4 OUTLIER -101.21 -56.06 2.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.383 -175.565 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.46 -21.03 49.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.472 -173.505 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.462 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . 71.62 19.98 78.22 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.336 -0.459 . . . . 0.0 113.257 175.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.468 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 2.2 mmp_? -77.62 179.14 6.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.716 0.258 . . . . 0.0 110.538 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -103.85 151.56 22.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.078 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -69.17 89.7 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 110.415 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.736 HG22 ' HB3' ' A' ' 18' ' ' PRO . 1.5 t -101.3 179.46 4.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.151 178.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.3 m 75.32 -47.97 0.61 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.396 0.679 . . . . 0.0 110.986 -177.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -134.52 75.79 0.41 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.777 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.71 95.3 0.92 Allowed 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.133 2.555 . . . . 0.0 112.477 -177.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.754 176.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 111.806 -0.517 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.53 50.28 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.326 0.584 . . . . 0.0 110.421 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 9.3 tpt -86.96 78.05 9.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.548 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.39 85.27 2.52 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 173.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 118.8 15.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.146 -175.165 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.581 ' HE3' ' HB2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -84.74 99.82 11.11 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 170.74 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -76.23 10.99 1.68 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.007 -173.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.581 ' HB2' ' HE3' ' A' ' 6' ' ' LYS . 1.7 t80 -74.68 92.85 2.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.7 103.12 2.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.201 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.77 170.27 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.442 177.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.35 168.67 12.08 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.244 -179.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.63 -45.17 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.456 -175.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -80.11 -15.33 79.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.59 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -70.8 143.33 51.19 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.443 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -130.24 165.34 22.62 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.764 -171.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -110.17 156.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 23.1 m -46.17 146.8 2.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 O-C-N 123.951 0.782 . . . . 0.0 112.999 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -69.13 -18.43 39.96 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.987 2.458 . . . . 0.0 113.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -123.85 171.46 9.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.124 0.488 . . . . 0.0 111.641 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.91 -24.92 22.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.296 177.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -78.63 -12.0 60.0 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.251 173.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -87.45 -83.6 0.2 Allowed 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.546 174.072 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.99 36.41 90.2 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.766 171.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.823 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 14.0 t-20 -104.78 159.28 15.91 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 117.333 0.566 . . . . 0.0 110.317 175.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.46 117.48 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 175.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.442 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -114.87 173.93 6.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.321 0.581 . . . . 0.0 111.456 -171.91 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -101.24 139.11 37.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.25 -179.834 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.25 -37.66 24.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.85 174.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.2 mtt-85 -84.09 18.22 2.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.919 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 0.8 OUTLIER -121.36 114.64 21.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.776 178.775 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.15 -9.58 59.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.089 0.471 . . . . 0.0 110.955 177.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -136.45 153.67 50.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 176.784 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.442 ' HA ' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -60.53 174.65 0.54 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.144 0.973 . . . . 0.0 113.53 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -100.16 -26.12 14.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.745 -1.571 . . . . 0.0 110.049 177.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -103.33 -65.41 1.01 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.528 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -40.64 38.21 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.981 0.42 . . . . 0.0 111.75 -175.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.437 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 86.28 49.02 4.35 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.365 176.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.598 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.9 OUTLIER -105.68 153.83 21.29 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.288 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.32 140.7 29.83 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.44 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.7 tttm -67.39 100.78 0.87 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.721 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.45 108.88 13.32 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.358 -178.081 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.82 -33.35 68.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.362 0.601 . . . . 0.0 109.483 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.434 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -160.0 147.89 15.61 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.909 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.507 ' HB2' ' H ' ' A' ' 45' ' ' ILE . 19.6 Cg_exo -66.33 -97.31 0.0 OUTLIER 'Trans proline' 0 CA--C 1.528 0.22 0 C-N-CA 122.694 2.263 . . . . 0.0 111.956 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.507 ' H ' ' HB2' ' A' ' 44' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.499 -0.763 . . . . 0.0 110.117 177.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.889 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.7 m 69.55 -67.58 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.435 0.694 . . . . 0.0 111.455 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.3 tpp -112.54 112.38 23.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.757 0.313 . . . . 0.0 110.298 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.31 134.6 40.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.695 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.42 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -72.41 98.78 2.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.252 176.377 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -77.09 -39.27 50.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.183 0.516 . . . . 0.0 110.061 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -99.94 122.09 42.32 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 175.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.1 t80 61.35 80.2 0.23 Allowed 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 123.806 0.691 . . . . 0.0 109.594 -172.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' HD2' ' O ' ' A' ' 5' ' ' THR . 4.3 mmm-85 -75.46 81.02 2.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.163 -174.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -83.52 82.89 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.405 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.62 34.76 2.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.054 172.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.44 -145.08 0.34 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.289 -172.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.69 19.58 36.3 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.45 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 3.3 p30 -73.37 176.22 6.21 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.158 -0.521 . . . . 0.0 110.465 178.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.511 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 32.7 p-90 -160.98 150.94 17.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.0 OUTLIER -102.3 157.53 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -43.15 140.54 2.02 Favored Pre-proline 0 C--O 1.236 0.353 0 O-C-N 123.886 0.741 . . . . 0.0 111.189 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 50.4 Cg_exo -56.26 -31.43 84.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.813 2.342 . . . . 0.0 112.661 -172.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.58 121.25 42.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttp -81.97 35.91 0.44 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -169.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -84.44 -14.16 50.07 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 165.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 t -108.12 -74.96 0.64 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.016 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 29.36 62.78 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.818 177.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 17.7 t30 -64.43 128.41 35.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.43 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.0 OUTLIER -79.19 99.02 3.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.193 0.52 . . . . 0.0 109.748 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -84.26 147.11 27.42 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.5 -176.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -37.02 -73.46 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.57 1.169 . . . . 0.0 112.568 -175.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 178.47 -59.32 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.414 0.626 . . . . 0.0 109.71 178.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 29' ' ' ARG . 1.2 mmt180 -91.28 11.35 23.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.528 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.583 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -68.09 115.34 7.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.111 174.187 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.59 -21.64 35.11 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.832 0.349 . . . . 0.0 110.868 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.583 ' O ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -127.05 148.7 50.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.214 178.591 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.711 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 52.2 t -57.1 138.16 54.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.092 0.472 . . . . 0.0 110.913 178.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.15 -20.98 60.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.078 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 35' ' ' ARG . 1.9 mtm-85 -91.92 -55.22 3.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.279 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.5 m -85.65 -59.61 2.26 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.716 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.711 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.19 -3.19 28.31 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -65.26 140.82 58.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 176.976 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.63 148.36 30.29 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.617 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -55.03 99.99 0.03 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.223 0.535 . . . . 0.0 110.966 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 2.06 50.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.589 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.0 113.82 24.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.315 -178.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 96.59 111.27 2.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.469 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.38 175.28 5.56 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 123.005 2.47 . . . . 0.0 112.635 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.359 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.51 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 20.3 p-90 -130.88 170.53 14.3 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.7 0.286 . . . . 0.0 111.206 -174.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.1 pt -121.44 155.45 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.174 175.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -41.85 142.78 1.05 Allowed Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 124.022 0.826 . . . . 0.0 111.984 -179.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.3 Cg_exo -61.72 -21.25 71.71 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.653 2.236 . . . . 0.0 112.048 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -103.8 149.43 25.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.903 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.37 -6.17 57.86 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.319 -173.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -65.74 -41.46 92.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.439 0.638 . . . . 0.0 109.733 175.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.42 -79.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.357 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.14 30.01 70.03 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.511 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 6.8 t30 -63.25 139.1 58.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.484 -0.358 . . . . 0.0 110.322 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -78.96 102.33 4.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.406 0.622 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.693 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 5.7 m120 -79.03 156.0 28.58 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.374 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.55 ' HB3' ' HG2' ' A' ' 30' ' ' ARG . 59.0 t80 -45.41 -82.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.03 0.831 . . . . 0.0 111.365 178.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 178.39 -66.65 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.97 53.72 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.768 173.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' A' ' 27' ' ' PHE . 55.0 mmt-85 -111.48 112.33 23.98 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.924 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -8.08 57.72 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.228 0.537 . . . . 0.0 109.722 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 1.5 m -140.56 152.41 45.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.509 174.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.785 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.6 t -53.63 152.7 4.92 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.494 0.664 . . . . 0.0 111.657 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.427 ' HB2' HD21 ' A' ' 24' ' ' ASN . 3.3 m-20 -85.04 -18.93 32.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.355 178.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.31 -52.06 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.151 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 58.0 m -79.41 -53.86 6.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.39 0.614 . . . . 0.0 111.508 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.785 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 94.08 13.83 53.41 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -167.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.2 OUTLIER -81.28 145.14 31.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.219 -0.491 . . . . 0.0 109.877 178.071 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -69.83 143.99 52.72 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -171.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -59.19 107.22 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.042 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 . . . . . 0 C--O 1.237 0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 109.926 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.599 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 3.3 p-90 -156.48 -166.8 2.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.4 -75.48 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.188 0.518 . . . . 0.0 109.87 175.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.615 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 44.7 t -142.97 155.24 62.51 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 174.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.615 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 17.9 Cg_exo -68.42 -14.2 39.41 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.983 1.789 . . . . 0.0 110.975 176.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 21' ' ' LYS . 2.6 t0 -106.59 177.62 4.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.794 177.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.79 -10.94 9.44 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.838 0.352 . . . . 0.0 110.545 -179.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 9.0 pttm -85.21 -2.87 58.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.542 177.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.426 ' HA ' ' NH1' ' A' ' 35' ' ' ARG . 44.0 t -119.41 -86.76 0.64 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.568 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 59.64 4.61 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.809 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 48.7 t30 -76.21 159.97 30.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.663 0.268 . . . . 0.0 110.723 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.85 62.1 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.228 0.537 . . . . 0.0 110.865 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.439 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 78.7 m-20 -89.53 125.7 35.3 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.409 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -84.15 171.51 12.77 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.03 -51.78 16.54 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -70.1 -12.48 61.63 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.572 ' O ' ' HZ2' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -79.23 86.46 5.0 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -0.79 12.66 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -142.06 135.39 29.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.75 0.31 . . . . 0.0 111.559 -177.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.439 ' HA ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 t -69.2 138.4 54.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.252 0.548 . . . . 0.0 109.886 174.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HA ' HH21 ' A' ' 38' ' ' ARG . 0.8 OUTLIER -100.43 2.52 42.3 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.637 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -104.87 -58.88 1.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.317 -174.627 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 24.7 p -93.26 -61.24 1.61 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.192 0.52 . . . . 0.0 111.661 -171.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 36' ' ' CYS . . . -133.5 -86.0 0.27 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.879 -175.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.456 HH21 ' HA ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -175.73 -132.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.681 0.24 . . . . 0.0 111.188 -169.175 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.432 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.59 145.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.77 0.828 . . . . 0.0 113.187 -173.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -64.34 104.36 0.76 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.968 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.422 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.307 0 CA-C-O 121.136 0.493 . . . . 0.0 110.039 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.475 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 8.8 p-90 -136.96 177.91 7.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.944 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.811 ' HB ' ' HA2' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -111.88 -108.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.155 -176.675 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.494 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.1 t -134.89 137.62 27.7 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.4 Cg_exo -62.55 -26.69 76.16 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.725 2.283 . . . . 0.0 112.395 -171.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HD3' ' A' ' 20' ' ' LYS . 6.8 t0 -147.1 178.03 8.7 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.591 ' HB2' ' HZ3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER 72.46 150.66 0.1 Allowed 'General case' 0 N--CA 1.432 -1.333 0 CA-C-O 122.123 0.963 . . . . 0.0 110.345 175.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 39.01 0.16 Allowed 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.527 172.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.479 ' H ' ' C ' ' A' ' 20' ' ' LYS . 14.2 t -77.2 -78.6 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.112 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.811 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 70.54 36.93 68.56 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.767 178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 4.8 t30 -70.73 131.2 43.5 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -77.73 99.28 2.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.476 0.655 . . . . 0.0 110.53 -177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -85.4 151.32 24.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.447 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -48.41 -80.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 O-C-N 123.816 0.697 . . . . 0.0 111.56 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -59.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.508 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 0.5 OUTLIER -83.52 52.28 2.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.873 178.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.58 ' NH2' ' HA ' ' A' ' 34' ' ' ASP . 0.1 OUTLIER -122.46 117.57 26.29 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.515 174.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -82.69 -3.72 56.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.931 0.396 . . . . 0.0 110.824 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 9.8 m -141.84 154.98 45.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.366 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.425 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.9 t -58.36 136.46 57.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.163 0.506 . . . . 0.0 110.693 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.58 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 12.3 t70 -72.63 -11.42 60.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.349 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -108.47 -57.77 2.09 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.989 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 39.8 m -79.14 -37.8 37.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 111.904 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.425 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 85.54 11.45 74.7 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -171.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 133.06 36.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.4 OUTLIER -77.07 158.53 30.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.37 -174.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.98 78.7 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.904 172.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.709 -173.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.231 0.127 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.524 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -129.74 -10.74 4.43 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.161 0.981 . . . . 0.0 109.904 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.524 ' HB ' ' O ' ' A' ' 15' ' ' TRP . 7.8 mm 71.11 138.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.444 0 CA-C-N 112.751 -2.022 . . . . 0.0 109.642 -172.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.435 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 24.7 t -42.66 146.44 0.73 Allowed Pre-proline 0 C--O 1.24 0.561 0 C-N-CA 122.832 0.453 . . . . 0.0 111.999 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.5 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -68.31 -13.78 38.62 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.42 2.08 . . . . 0.0 111.379 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -98.18 -178.72 4.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.948 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.1 11.48 11.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.014 0.435 . . . . 0.0 110.567 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -97.97 -24.07 15.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.779 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.644 ' SG ' ' HB3' ' A' ' 35' ' ' ARG . 59.5 m -97.06 -73.11 0.62 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.409 0.623 . . . . 0.0 111.454 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 16' ' ' ILE . . . 69.52 37.17 78.06 Favored Glycine 0 N--CA 1.44 -1.047 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 -166.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.96 137.77 58.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.534 -0.833 . . . . 0.0 111.568 -176.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -86.62 87.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.018 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.7 166.76 21.48 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.715 -173.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -65.27 -74.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -179.09 -76.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.079 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 37.1 mmt-85 -77.45 42.79 0.36 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.067 -178.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.86 135.19 39.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 174.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 1.38 51.7 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.0 0.429 . . . . 0.0 110.504 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.98 155.63 41.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.591 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 40.7 t -67.78 155.1 40.07 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.5 176.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -17.57 17.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.373 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.644 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -88.19 -45.64 9.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.938 -178.323 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -113.45 -55.75 2.48 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.956 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.53 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 125.74 8.92 5.05 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.09 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -62.21 137.5 58.27 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -75.68 153.68 36.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.357 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -58.6 107.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.638 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 121.013 0.435 . . . . 0.0 111.482 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 . . . . . 0 CA--C 1.517 -0.297 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.507 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 23.5 p-90 -125.03 133.27 53.02 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.535 HG13 ' H ' ' A' ' 17' ' ' CYS . 0.9 OUTLIER -69.7 -55.51 14.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.703 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.535 ' H ' HG13 ' A' ' 16' ' ' ILE . 3.6 m -162.55 168.07 11.21 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.495 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 23.1 Cg_exo -64.74 -35.05 47.99 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.935 1.757 . . . . 0.0 111.19 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.707 ' HB3' ' HG2' ' A' ' 21' ' ' LYS . 29.8 t0 -155.17 163.4 40.25 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.116 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 31.78 0.16 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.937 0.399 . . . . 0.0 111.249 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.707 ' HG2' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -79.12 -38.98 34.8 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 173.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.65 -91.25 0.28 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.632 0.729 . . . . 0.0 109.408 170.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.48 64.69 0.45 Allowed Glycine 0 C--N 1.314 -0.685 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.717 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 51.4 t30 -105.8 -173.22 2.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.49 90.31 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.198 0.523 . . . . 0.0 109.676 174.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -95.3 167.49 11.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.519 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.691 ' HD2' ' HG2' ' A' ' 29' ' ' ARG . 3.9 t80 -102.22 144.05 31.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.955 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -51.11 -34.02 28.81 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.691 ' HG2' ' HD2' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -80.51 -3.84 51.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.944 0.402 . . . . 0.0 110.837 -179.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 15.9 mtt-85 -80.42 129.28 34.41 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.13 -12.73 40.24 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.295 0.569 . . . . 0.0 110.646 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.16 158.19 43.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.677 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.477 ' SG ' ' HD3' ' A' ' 18' ' ' PRO . 64.6 m -54.82 136.11 47.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.821 171.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.93 -41.9 18.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.894 0.378 . . . . 0.0 111.71 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -42.79 8.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.087 0.47 . . . . 0.0 110.745 -174.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.449 ' SG ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.94 -57.45 3.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.854 -176.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.456 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 111.31 19.94 7.29 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.487 -0.863 . . . . 0.0 114.638 174.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.449 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -91.91 167.37 12.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.853 0.827 . . . . 0.0 109.089 173.049 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pm0 -96.39 151.86 19.14 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 121.93 -0.482 . . . . 0.0 110.624 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.4 68.9 2.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.149 0.5 . . . . 0.0 110.071 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.767 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.234 0.285 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.712 ' HH2' HH12 ' A' ' 38' ' ' ARG . 6.6 p-90 -127.17 149.48 49.95 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.145 0.498 . . . . 0.0 110.903 -177.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' HA ' ' A' ' 25' ' ' VAL . 3.8 pt -98.8 -117.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.72 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.543 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 5.5 t -123.2 149.88 58.58 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 175.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.543 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 46.4 Cg_exo -57.18 -29.99 85.56 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.989 1.792 . . . . 0.0 112.444 -177.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 20' ' ' LYS . 18.7 t70 -110.97 -174.94 2.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.976 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 5.3 mtmm -103.27 -9.95 19.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.161 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -60.41 -37.8 82.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.112 0.482 . . . . 0.0 110.265 177.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.555 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -88.02 -79.74 0.29 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.509 0.671 . . . . 0.0 110.317 174.593 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.48 27.37 73.55 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -170.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 32.7 t30 -84.19 133.61 34.59 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.014 -0.593 . . . . 0.0 110.677 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.458 ' HA ' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -78.16 92.29 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.482 0.658 . . . . 0.0 110.492 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 34' ' ' ASP . 91.4 m-20 -79.93 -172.88 3.6 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.413 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.798 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 2.2 t80 -73.75 -131.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.09 -62.99 0.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.95 41.61 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.241 175.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.798 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -111.01 121.48 45.47 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.459 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.69 21.3 8.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.604 0.716 . . . . 0.0 109.933 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.2 m -153.99 150.69 28.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.446 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.916 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -63.54 158.5 20.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.404 0.621 . . . . 0.0 111.8 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 0.5 OUTLIER -92.9 -18.75 22.4 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.391 174.607 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.555 ' NH2' ' HA ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -104.44 -68.26 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.678 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.726 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 29.5 p -79.91 -30.4 40.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.195 0.521 . . . . 0.0 110.259 -176.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.916 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 87.72 6.68 76.23 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.881 -0.676 . . . . 0.0 113.926 168.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.726 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -73.04 166.85 22.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.633 0.717 . . . . 0.0 110.051 177.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.485 ' O ' ' HD2' ' A' ' 38' ' ' ARG . 20.3 pm0 -74.25 175.69 7.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.515 -177.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -77.52 55.08 1.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.849 0.833 . . . . 0.0 110.555 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.313 -0.995 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.393 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.352 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.469 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 39.6 p-90 -160.98 148.43 15.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.705 0.288 . . . . 0.0 110.618 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -99.92 157.12 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 6.2 m -47.62 144.69 4.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 123.879 0.737 . . . . 0.0 111.916 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' H ' ' A' ' 41' ' ' THR . 11.8 Cg_exo -69.62 -31.59 20.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.551 2.167 . . . . 0.0 113.981 -164.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 20' ' ' LYS . 4.7 t70 -116.04 172.15 7.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.139 0.495 . . . . 0.0 111.551 -174.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -77.95 -25.45 48.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.993 -178.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.3 mmtm -71.24 -16.29 62.49 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.485 0.66 . . . . 0.0 110.005 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 1.2 m -97.2 -85.81 0.35 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.55 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.01 14.24 67.86 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.177 -0.919 . . . . 0.0 113.65 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.764 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 1.7 t30 -80.23 153.65 28.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.939 0.399 . . . . 0.0 111.219 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -93.33 106.71 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.512 . . . . 0.0 110.07 174.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.593 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -87.95 176.36 7.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.029 -174.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -61.89 -89.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.401 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -65.14 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.539 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 3.0 mmt-85 -78.66 56.46 1.85 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.173 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.8 mmt-85 -126.43 129.93 49.7 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.599 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.71 -3.21 42.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.488 0.661 . . . . 0.0 109.864 172.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -130.98 166.41 21.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.491 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.695 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 85.2 m -56.9 169.48 0.51 Allowed 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.97 0.891 . . . . 0.0 113.176 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 26' ' ' ASN . 3.2 t70 -99.68 -41.35 7.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.44 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.509 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -105.78 -48.01 3.74 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.357 -177.508 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.27 -43.26 42.51 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -171.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.695 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 90.84 37.7 6.32 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.322 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -100.63 170.45 8.36 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.012 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -91.26 149.47 21.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -57.28 102.32 0.09 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.118 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.562 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.932 177.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.022 0.439 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.591 ' HH2' HH12 ' A' ' 38' ' ' ARG . 13.5 p-90 -130.36 171.56 12.81 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -112.16 -101.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.417 -176.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' NH2' ' A' ' 38' ' ' ARG . 6.5 t -146.1 148.2 34.43 Favored Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.0 Cg_exo -62.03 -28.08 80.04 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.113 1.875 . . . . 0.0 111.981 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.73 176.94 7.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.661 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 -14.16 12.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.137 -176.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -26.87 37.04 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.941 0.401 . . . . 0.0 110.171 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.28 -78.44 0.17 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.02 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.25 23.78 74.83 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.943 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 8.9 t30 -65.91 135.47 54.81 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 122.161 0.184 . . . . 0.0 110.579 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -78.5 96.63 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.545 0.688 . . . . 0.0 109.811 176.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.763 HD21 ' HA ' ' A' ' 33' ' ' CYS . 5.3 m-80 -83.28 -174.46 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.126 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -76.64 -135.59 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.612 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -134.03 -50.46 0.82 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -87.56 13.4 10.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.907 175.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.96 125.79 29.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.023 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.89 -8.92 48.06 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.034 0.445 . . . . 0.0 110.507 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.2 149.33 50.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.808 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.763 ' HA ' HD21 ' A' ' 26' ' ' ASN . 2.9 t -62.59 160.62 13.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.028 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -100.76 -26.15 13.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.78 -64.98 1.03 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.079 -176.172 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 21.5 p -80.58 -40.07 26.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.596 -176.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.65 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.48 7.95 47.57 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.679 -0.772 . . . . 0.0 114.153 169.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.732 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -79.32 169.69 17.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.294 0.547 . . . . 0.0 110.941 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -90.05 155.84 18.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.89 0.376 . . . . 0.0 110.791 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -76.72 107.44 9.03 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.853 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.845 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 14.5 p-10 . . . . . 0 C--O 1.237 0.444 0 CA-C-O 121.243 0.544 . . . . 0.0 111.511 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CD2' ' HE2' ' A' ' 40' ' ' LYS . 12.1 p-90 -155.59 171.79 19.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.411 177.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.74 153.43 14.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 171.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.843 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 92.7 m -42.03 146.14 0.67 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.372 1.045 . . . . 0.0 112.516 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 31.4 Cg_exo -58.7 -28.04 85.21 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.94 2.427 . . . . 0.0 113.707 -172.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -121.24 177.17 5.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.162 0.506 . . . . 0.0 111.578 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.35 -27.43 19.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.185 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -70.32 -24.34 62.99 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -80.56 -82.43 0.12 Allowed 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.492 171.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.96 47.66 59.36 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.353 -0.84 . . . . 0.0 114.913 174.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.843 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 3.3 t30 -105.66 155.61 19.07 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 117.075 0.438 . . . . 0.0 110.847 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.422 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -85.2 110.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.916 173.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -88.69 160.78 17.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.401 -177.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -51.72 -76.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.652 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 179.67 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.711 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.22 51.88 1.89 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.228 0.537 . . . . 0.0 110.381 179.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -108.31 128.49 54.79 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.419 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.97 7.22 43.15 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.963 0.411 . . . . 0.0 110.913 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.77 156.27 44.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.726 177.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 153.69 11.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 175.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.86 -7.93 23.07 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -169.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.89 -36.89 0.2 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -172.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.55 -29.4 3.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -160.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.72 -109.73 2.1 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.196 -1.002 . . . . 0.0 113.514 -170.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.423 ' HB3' ' H ' ' A' ' 39' ' ' GLU . 2.9 mmt180 -171.19 -156.56 0.12 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.391 0.139 . . . . 0.0 110.979 -171.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.423 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.9 148.63 0.52 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.457 ' HE2' ' CD2' ' A' ' 15' ' ' TRP . 35.0 tttm -59.59 92.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.945 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.305 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.518 -0.254 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.558 ' CE2' ' HG3' ' A' ' 40' ' ' LYS . 12.5 p-90 -161.07 164.18 30.97 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.983 0.421 . . . . 0.0 111.213 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pt -115.31 159.53 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 36.8 t -46.28 141.0 5.03 Favored Pre-proline 0 C--O 1.236 0.373 0 O-C-N 123.744 0.653 . . . . 0.0 111.669 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.557 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 7.6 Cg_exo -76.79 -10.56 18.37 Favored 'Trans proline' 0 N--CA 1.446 -1.299 0 C-N-CA 122.02 1.813 . . . . 0.0 111.435 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -106.46 160.64 15.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.653 -174.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -96.25 20.05 10.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.236 -176.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 -35.75 12.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.065 0.459 . . . . 0.0 109.8 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.1 m -99.28 -79.26 0.49 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.526 0.679 . . . . 0.0 111.475 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.73 21.72 76.23 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 -165.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.514 HD21 ' HB2' ' A' ' 34' ' ' ASP . 6.1 t30 -64.41 144.43 57.17 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 113.507 -1.347 . . . . 0.0 110.525 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.64 99.14 8.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.375 0.607 . . . . 0.0 109.8 174.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.55 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 3.5 m120 -78.7 163.2 25.62 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.816 -176.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.28 -85.24 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.556 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.412 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . 179.98 -58.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 7.4 mmm180 -78.11 31.74 0.18 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.62 175.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' H ' ' C ' ' A' ' 28' ' ' ALA . 63.6 mmt-85 -98.53 121.35 40.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.225 -176.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.69 -5.55 51.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.118 0.485 . . . . 0.0 110.435 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.1 m -142.82 168.1 20.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.331 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.841 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 17.2 t -63.06 156.93 23.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.593 0.711 . . . . 0.0 111.585 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.514 ' HB2' HD21 ' A' ' 24' ' ' ASN . 3.8 m-20 -96.11 -9.78 29.91 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.142 176.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -110.89 -59.85 1.91 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.829 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.0 p -94.52 -55.12 3.26 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.192 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.841 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.71 9.03 4.08 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.505 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -64.19 149.78 47.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.927 0.364 . . . . 0.0 110.439 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.43 155.74 37.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.615 0.245 . . . . 0.0 111.003 -175.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.558 ' HG3' ' CE2' ' A' ' 15' ' ' TRP . 17.4 tttm -64.17 90.39 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.501 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.338 -176.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . 4.2 m-20 . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.528 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 6.4 p-90 -145.66 153.84 41.45 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.8 -80.02 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 4.6 m -149.92 151.67 32.75 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.647 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 10.0 Cg_exo -75.18 -17.9 18.78 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.82 2.347 . . . . 0.0 112.433 -175.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 22' ' ' CYS . 42.5 t0 -122.82 162.63 21.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.95 -170.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -15.97 32.76 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 175.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -90.55 6.58 43.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.668 174.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -98.24 -89.53 0.3 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.05 179.099 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.476 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 72.38 55.7 6.69 Favored Glycine 0 CA--C 1.521 0.451 0 CA-C-N 115.18 -0.918 . . . . 0.0 114.35 173.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.611 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 18.6 t30 -123.79 167.64 13.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 173.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.0 104.63 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.965 0.412 . . . . 0.0 110.142 176.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -102.05 178.6 4.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.117 0.484 . . . . 0.0 111.628 -174.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.457 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -100.88 135.77 41.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.106 177.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB2' ' HA ' ' A' ' 14' ' ' ASP . . . -47.05 -51.59 17.09 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.213 0.605 . . . . 0.0 112.605 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 29' ' ' ARG . 4.1 ptt180 -69.74 -16.13 63.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.541 -177.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.2 mmt180 -74.36 133.98 42.49 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.8 2.22 40.95 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.933 0.397 . . . . 0.0 110.651 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -133.76 150.16 51.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.351 -178.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.54 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 34.0 m -70.04 145.48 51.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.927 175.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -83.97 -45.37 13.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.642 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 9.2 mmt180 -91.73 -48.46 6.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.049 0.452 . . . . 0.0 111.498 -174.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -45.36 24.67 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.203 -173.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.59 23.01 14.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.798 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.54 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -96.0 -164.04 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.496 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.0 mp0 -125.26 158.48 33.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -72.47 74.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.106 0.479 . . . . 0.0 110.869 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.319 -0.731 0 CA-C-O 121.289 0.566 . . . . 0.0 110.362 179.316 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.134 0.492 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.509 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 24.1 p-90 -160.09 153.94 22.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.325 173.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.08 156.48 8.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.426 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . 3.7 t -43.85 143.72 1.64 Allowed Pre-proline 0 C--O 1.235 0.329 0 O-C-N 123.778 0.674 . . . . 0.0 111.124 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.509 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.6 Cg_exo -63.55 -20.44 69.53 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.376 2.051 . . . . 0.0 112.278 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -111.65 149.58 31.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.449 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.22 -1.74 50.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.392 -174.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -76.29 -15.29 60.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.402 0.62 . . . . 0.0 110.053 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB2' HH21 ' A' ' 38' ' ' ARG . 0.1 OUTLIER -110.3 -82.39 0.57 Allowed 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.705 178.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.75 17.68 80.06 Favored Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.294 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.839 ' HB2' ' HD3' ' A' ' 35' ' ' ARG . 14.9 t30 -62.59 134.7 56.75 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -80.05 90.24 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.674 0.75 . . . . 0.0 110.363 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -79.61 112.93 17.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.917 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -19.52 -79.5 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.102 1.501 . . . . 0.0 113.997 -175.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -176.5 -64.73 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.08 41.35 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.519 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.6 mmt-85 -108.82 104.89 14.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.575 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.92 -10.91 59.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.271 0.557 . . . . 0.0 111.187 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -141.38 146.71 36.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.796 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 31.0 t -56.99 145.66 29.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.008 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -89.11 -15.96 32.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.175 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.839 ' HD3' ' HB2' ' A' ' 24' ' ' ASN . 3.6 ttp180 -95.15 -44.01 7.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.417 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.585 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 15.3 p -127.31 -26.31 3.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.796 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 100.25 14.38 33.36 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.555 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.76 HH21 ' HB2' ' A' ' 22' ' ' CYS . 2.9 tpp180 -60.92 143.81 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.862 0.363 . . . . 0.0 110.693 176.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.44 155.71 39.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -72.59 67.3 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.975 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.785 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 . . . . . 0 C--O 1.236 0.361 0 CA-C-O 120.845 0.355 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.481 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 1.1 p-90 -133.35 -167.06 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.266 -170.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.6 OUTLIER -122.36 -60.17 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 47.6 t -177.9 155.31 1.03 Allowed Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.635 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 23.1 Cg_exo -66.28 -13.48 40.04 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.967 1.778 . . . . 0.0 111.902 172.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -101.68 -173.61 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.794 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -6.56 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.628 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -93.47 2.9 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.221 0.534 . . . . 0.0 110.012 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.488 ' HA ' HH21 ' A' ' 35' ' ' ARG . 5.8 t -104.21 -81.62 0.52 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.355 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.87 50.77 17.38 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.497 -0.858 . . . . 0.0 110.978 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.498 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 25.0 t30 -81.08 177.3 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.28 -0.46 . . . . 0.0 109.837 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.49 91.38 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.221 0.534 . . . . 0.0 110.204 175.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.778 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.78 151.97 25.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.284 0.564 . . . . 0.0 110.568 -179.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 1.9 t80 -81.64 148.03 29.25 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.134 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -43.26 -42.52 4.42 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.844 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -78.28 2.84 17.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.854 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.8 mmm180 -97.3 118.3 33.45 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 175.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -5.67 59.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.612 -177.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -140.62 159.94 41.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.478 -178.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HA ' HD22 ' A' ' 26' ' ' ASN . 53.2 t -60.74 144.24 52.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.971 0.415 . . . . 0.0 109.901 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.481 ' HB2' HD21 ' A' ' 24' ' ' ASN . 0.2 OUTLIER -84.82 -8.42 58.81 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.488 HH21 ' HA ' ' A' ' 22' ' ' CYS . 0.3 OUTLIER -106.67 -52.84 2.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.171 178.801 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 86.1 m -78.73 -39.24 36.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.674 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.68 9.98 85.74 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.625 -0.797 . . . . 0.0 111.55 -175.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -88.94 143.12 27.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -70.66 156.2 39.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.377 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.39 110.16 1.36 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.711 173.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.235 0.292 0 CA-C-O 120.858 0.361 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.696 ' CZ3' ' HG3' ' A' ' 40' ' ' LYS . 50.9 p-90 -107.85 165.87 11.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.463 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.521 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.1 pp -106.32 150.48 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.762 175.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 56.7 m -41.09 150.42 0.31 Allowed Pre-proline 0 CA--C 1.537 0.447 0 O-C-N 124.45 1.094 . . . . 0.0 113.314 -177.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.974 ' HG3' ' HA ' ' A' ' 40' ' ' LYS . 34.3 Cg_exo -59.25 -31.12 94.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 123.368 2.712 . . . . 0.0 113.822 -174.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -114.91 167.88 10.4 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.015 0.436 . . . . 0.0 111.462 -173.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.85 -36.42 49.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.485 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -30.23 71.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.685 175.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -76.94 -83.72 0.07 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.852 177.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.481 ' N ' ' HB2' ' A' ' 17' ' ' CYS . . . 51.75 40.22 48.43 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.2 -0.909 . . . . 0.0 114.559 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.848 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 5.3 t30 -100.47 158.22 16.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 117.218 0.509 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.25 120.82 37.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.239 0.542 . . . . 0.0 110.579 177.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.31 177.47 4.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.545 -177.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.832 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 19.6 t80 -62.67 -93.38 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.702 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -163.42 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.48 42.22 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.519 0.676 . . . . 0.0 110.591 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.832 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -92.11 138.99 31.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.761 177.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -31.7 18.55 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.728 0.299 . . . . 0.0 110.845 177.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.765 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -114.74 159.15 20.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.085 0.469 . . . . 0.0 112.07 -175.365 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -59.63 159.08 8.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.022 175.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.39 -21.54 17.12 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.876 -170.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -142.71 -30.73 0.53 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.35 -16.34 2.75 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -158.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' SG ' ' A' ' 33' ' ' CYS . . . -139.96 -112.61 1.01 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 119.28 -1.438 . . . . 0.0 114.596 -172.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.95 -160.03 0.77 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.669 -0.265 . . . . 0.0 110.61 -167.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.765 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.7 mt-10 -64.51 149.5 48.52 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.974 ' HA ' ' HG3' ' A' ' 18' ' ' PRO . 1.7 tttm -65.49 107.46 1.69 Allowed 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.795 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.498 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 2.8 p . . . . . 0 C--N 1.318 -0.794 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.125 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.368 0.604 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.508 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p-90 -151.02 167.4 27.76 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -122.1 148.65 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 24' ' ' ASN . 4.0 m -39.61 141.67 0.7 Allowed Pre-proline 0 C--O 1.239 0.543 0 O-C-N 124.27 0.981 . . . . 0.0 113.095 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.508 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 31.2 Cg_exo -61.21 -25.04 80.15 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.426 2.084 . . . . 0.0 111.818 -176.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 21' ' ' LYS . 12.2 t70 -112.47 123.67 50.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.827 178.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.04 11.45 2.73 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -170.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -76.51 -30.05 57.04 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.28 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.8 ' HA ' HH21 ' A' ' 35' ' ' ARG . 53.2 t -96.31 -70.03 0.73 Allowed 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.11 52.07 53.59 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.469 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 t30 -87.41 150.7 23.62 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.094 -177.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.88 88.08 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.183 0.516 . . . . 0.0 110.112 177.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.886 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.25 118.45 21.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.628 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -18.63 -82.49 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 O-C-N 125.13 1.518 . . . . 0.0 113.918 -170.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.45 -50.26 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.28 23.63 2.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.632 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 32' ' ' SER . 0.6 OUTLIER -96.58 115.54 27.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.446 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.94 -1.35 52.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 175.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -145.42 163.98 32.94 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.551 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 1.002 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 25.2 t -64.58 167.97 6.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.81 0.814 . . . . 0.0 112.018 175.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.0 -4.87 26.67 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.547 170.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.8 HH21 ' HA ' ' A' ' 22' ' ' CYS . 1.0 OUTLIER -123.95 -66.72 0.97 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.871 -177.434 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 25.9 p -80.0 -23.49 41.51 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.064 0.459 . . . . 0.0 110.636 -175.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 1.002 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 78.0 7.56 87.53 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.406 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.512 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -66.58 140.01 57.93 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.85 143.2 32.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.262 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -63.32 96.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.701 -178.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.772 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.642 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.234 0.283 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.483 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 14.1 p-90 -152.09 154.18 35.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.096 0.474 . . . . 0.0 111.134 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -109.96 160.71 8.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.485 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 9.2 t -45.99 144.24 3.0 Favored Pre-proline 0 N--CA 1.463 0.192 0 O-C-N 123.809 0.693 . . . . 0.0 111.12 -178.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.485 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 18.9 Cg_exo -66.56 -2.63 7.71 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.41 2.074 . . . . 0.0 112.464 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -112.33 163.98 13.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.977 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.81 -21.39 16.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.993 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HG2' ' N ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -68.86 -29.53 67.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.361 0.6 . . . . 0.0 110.007 177.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.444 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -90.18 -83.01 0.26 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.102 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.21 35.28 64.03 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -175.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -67.43 144.29 55.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.325 -0.437 . . . . 0.0 110.136 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.83 87.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.602 0.715 . . . . 0.0 111.021 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.448 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -79.82 118.54 21.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.463 178.271 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -34.81 -75.13 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 124.125 0.891 . . . . 0.0 112.697 -177.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 176.69 -47.67 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -174.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.723 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -88.88 77.09 7.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 175.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 30' ' ' ARG . 2.0 mmt85 -151.79 117.88 5.55 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.13 -1.395 . . . . 0.0 108.688 -176.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -96.33 -7.41 35.33 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.276 0.56 . . . . 0.0 110.667 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -147.41 173.03 13.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.503 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.823 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 8.0 t -65.82 154.43 39.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.278 0.561 . . . . 0.0 111.564 176.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.53 -9.34 22.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.172 173.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -101.0 -69.4 0.78 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.077 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 28.5 p -91.21 -34.88 14.81 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.059 -174.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.823 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 105.39 7.25 37.66 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.28 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.465 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -57.95 140.53 51.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.027 0.441 . . . . 0.0 110.711 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.0 pm0 -72.75 171.11 13.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.844 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -76.33 58.92 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.242 0.544 . . . . 0.0 109.898 176.544 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.287 -177.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.229 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.518 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 29.2 p-90 -160.39 157.26 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.624 0.25 . . . . 0.0 110.716 -176.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.8 pt -102.23 158.26 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 5.8 t -45.68 144.21 2.72 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 123.554 0.534 . . . . 0.0 111.806 -177.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 12.5 Cg_exo -72.67 1.52 6.24 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.023 2.482 . . . . 0.0 112.297 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.87 160.16 33.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.663 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -89.28 -19.93 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.831 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.703 ' HB2' HH22 ' A' ' 38' ' ' ARG . 31.3 mttt -62.42 -22.53 66.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.132 0.491 . . . . 0.0 110.874 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -86.35 0.42 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.427 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.4 26.3 57.45 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.371 -174.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 7.8 t30 -80.02 134.86 36.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.591 -0.305 . . . . 0.0 110.924 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.66 114.78 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.976 0.417 . . . . 0.0 109.885 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.42 158.11 17.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.499 ' O ' ' HB3' ' A' ' 14' ' ' ASP . 35.2 t80 -53.3 -77.7 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 O-C-N 123.572 0.545 . . . . 0.0 112.055 -175.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -178.34 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.122 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -71.39 24.37 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.774 177.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 32' ' ' SER . 11.7 mmt-85 -90.51 122.55 33.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.174 -177.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 -17.52 24.39 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.355 0.598 . . . . 0.0 109.631 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 50.8 m -132.35 168.41 18.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.397 174.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.484 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -64.0 164.51 10.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.937 0.875 . . . . 0.0 113.112 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -101.0 -24.69 14.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.213 170.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.58 -58.38 2.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.509 -171.292 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.516 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 31.2 p -93.65 -57.16 2.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.948 0.404 . . . . 0.0 110.753 -175.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.484 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.94 0.28 6.55 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.739 -178.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.703 HH22 ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.97 142.57 55.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.0 pm0 -87.63 172.87 9.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.416 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.66 67.86 0.8 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.858 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.635 -175.578 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.679 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 7.9 t70 . . . . . 0 CA--C 1.515 -0.367 0 CA-C-O 121.635 0.731 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.465 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 7.5 p-90 -160.16 161.24 33.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.743 -178.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -108.41 -75.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.781 177.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 1.5 m -147.53 152.67 42.35 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.736 ' HB3' HG22 ' A' ' 41' ' ' THR . 17.4 Cg_exo -68.87 -30.01 27.36 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.036 2.491 . . . . 0.0 113.425 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -127.9 -175.2 3.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.054 0.454 . . . . 0.0 111.867 -173.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -93.13 -29.92 15.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.841 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -4.06 33.85 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.742 174.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -88.38 -85.33 0.19 Allowed 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.752 175.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.65 75.36 Favored Glycine 0 CA--C 1.518 0.253 0 CA-C-N 114.761 -1.109 . . . . 0.0 114.256 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 17.4 t30 -92.41 158.03 16.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.06 94.46 4.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.482 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -93.18 164.42 13.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.928 0.394 . . . . 0.0 110.613 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.453 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 t80 -83.91 -92.58 0.08 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.469 -173.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.679 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . . . -166.09 -62.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.247 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -81.01 21.61 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.221 0.534 . . . . 0.0 110.599 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 6.0 mtp85 -90.89 114.7 27.22 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.92 -0.67 57.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.264 0.554 . . . . 0.0 110.634 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -146.15 153.75 41.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.118 177.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.468 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 88.4 m -59.13 143.43 48.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.598 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.412 ' HB3' HD21 ' A' ' 24' ' ' ASN . 17.9 t70 -75.1 -37.66 61.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.995 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.21 -56.06 2.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.383 -175.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.46 -21.03 49.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.472 -173.505 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.462 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . 71.62 19.98 78.22 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.336 -0.459 . . . . 0.0 113.257 175.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.468 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 2.2 mmp_? -77.62 179.14 6.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.716 0.258 . . . . 0.0 110.538 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -103.85 151.56 22.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.078 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -69.17 89.7 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 110.415 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.736 HG22 ' HB3' ' A' ' 18' ' ' PRO . 1.5 t . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.151 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 CA--C 1.52 -0.2 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.443 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -130.24 165.34 22.62 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.764 -171.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -110.17 156.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 23.1 m -46.17 146.8 2.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 O-C-N 123.951 0.782 . . . . 0.0 112.999 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -69.13 -18.43 39.96 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.987 2.458 . . . . 0.0 113.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -123.85 171.46 9.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.124 0.488 . . . . 0.0 111.641 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.91 -24.92 22.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.296 177.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -78.63 -12.0 60.0 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.251 173.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -87.45 -83.6 0.2 Allowed 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.546 174.072 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.99 36.41 90.2 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.766 171.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.823 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 6.4 t30 -104.78 159.28 15.91 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 117.333 0.566 . . . . 0.0 110.317 175.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.46 117.48 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 175.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.442 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -114.87 173.93 6.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.321 0.581 . . . . 0.0 111.456 -171.91 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -101.24 139.11 37.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.25 -179.834 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.25 -37.66 24.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.85 174.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.2 mtt-85 -84.09 18.22 2.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.919 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 0.8 OUTLIER -121.36 114.64 21.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.776 178.775 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.15 -9.58 59.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.089 0.471 . . . . 0.0 110.955 177.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -136.45 153.67 50.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 176.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.442 ' HA ' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -60.53 174.65 0.54 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.144 0.973 . . . . 0.0 113.53 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -100.16 -26.12 14.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.745 -1.571 . . . . 0.0 110.049 177.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -103.33 -65.41 1.01 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.528 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -40.64 38.21 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.981 0.42 . . . . 0.0 111.75 -175.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.437 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 86.28 49.02 4.35 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.365 176.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.598 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.9 OUTLIER -105.68 153.83 21.29 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.288 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.32 140.7 29.83 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.44 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.7 tttm -67.39 100.78 0.87 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.721 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.32 -0.674 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.358 -178.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.45 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 3.3 p30 . . . . . 0 C--O 1.235 0.323 0 CA-C-O 120.965 0.412 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.511 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 32.7 p-90 -160.98 150.94 17.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.0 OUTLIER -102.3 157.53 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -43.15 140.54 2.02 Favored Pre-proline 0 C--O 1.236 0.353 0 O-C-N 123.886 0.741 . . . . 0.0 111.189 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 50.4 Cg_exo -56.26 -31.43 84.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.813 2.342 . . . . 0.0 112.661 -172.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.58 121.25 42.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttp -81.97 35.91 0.44 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -169.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -84.44 -14.16 50.07 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 165.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 t -108.12 -74.96 0.64 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.016 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 29.36 62.78 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.818 177.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 17.7 t30 -64.43 128.41 35.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.43 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.0 OUTLIER -79.19 99.02 3.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.193 0.52 . . . . 0.0 109.748 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -84.26 147.11 27.42 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.5 -176.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -37.02 -73.46 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.57 1.169 . . . . 0.0 112.568 -175.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 178.47 -59.32 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.414 0.626 . . . . 0.0 109.71 178.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 29' ' ' ARG . 1.2 mmt180 -91.28 11.35 23.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.528 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.583 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -68.09 115.34 7.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.111 174.187 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.59 -21.64 35.11 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.832 0.349 . . . . 0.0 110.868 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.583 ' O ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -127.05 148.7 50.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.214 178.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.711 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 52.2 t -57.1 138.16 54.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.092 0.472 . . . . 0.0 110.913 178.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.15 -20.98 60.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.078 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 35' ' ' ARG . 1.9 mtm-85 -91.92 -55.22 3.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.279 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.5 m -85.65 -59.61 2.26 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.716 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.711 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.19 -3.19 28.31 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -65.26 140.82 58.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 176.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.63 148.36 30.29 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.617 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -55.03 99.99 0.03 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.223 0.535 . . . . 0.0 110.966 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.589 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.11 159.66 31.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.637 0.256 . . . . 0.0 111.381 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.64 83.71 0.15 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.254 178.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.71 103.2 0.53 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.807 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.15 130.91 53.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.323 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.15 -29.41 60.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.447 0.641 . . . . 0.0 109.596 175.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -93.17 165.03 13.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.283 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD2' HG12 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -89.64 -165.84 1.45 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.357 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.1 mmt-85 -91.59 49.43 1.58 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.536 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -156.31 161.64 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.622 -174.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.74 -160.53 0.8 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.878 0.371 . . . . 0.0 111.455 -177.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.21 -51.43 17.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.838 -176.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.93 -45.46 10.47 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.853 -174.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.79 143.36 44.04 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.51 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 20.3 p-90 -130.88 170.53 14.3 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.7 0.286 . . . . 0.0 111.206 -174.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.1 pt -121.44 155.45 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.174 175.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -41.85 142.78 1.05 Allowed Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 124.022 0.826 . . . . 0.0 111.984 -179.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.51 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.3 Cg_exo -61.72 -21.25 71.71 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.653 2.236 . . . . 0.0 112.048 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -103.8 149.43 25.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.903 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.37 -6.17 57.86 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.319 -173.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -65.74 -41.46 92.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.439 0.638 . . . . 0.0 109.733 175.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.42 -79.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.357 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.14 30.01 70.03 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.511 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 6.8 t30 -63.25 139.1 58.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.484 -0.358 . . . . 0.0 110.322 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 m -78.96 102.33 4.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.406 0.622 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.693 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 5.7 m120 -79.03 156.0 28.58 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.374 -175.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.55 ' HB3' ' HG2' ' A' ' 30' ' ' ARG . 59.0 t80 -45.41 -82.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.03 0.831 . . . . 0.0 111.365 178.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 178.39 -66.65 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.97 53.72 0.96 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.768 173.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' A' ' 27' ' ' PHE . 55.0 mmt-85 -111.48 112.33 23.98 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.924 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -8.08 57.72 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.228 0.537 . . . . 0.0 109.722 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.448 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 1.5 m -140.56 152.41 45.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.509 174.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.785 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.6 t -53.63 152.7 4.92 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.494 0.664 . . . . 0.0 111.657 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.427 ' HB2' HD21 ' A' ' 24' ' ' ASN . 3.3 m-20 -85.04 -18.93 32.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.355 178.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.31 -52.06 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.151 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 58.0 m -79.41 -53.86 6.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.39 0.614 . . . . 0.0 111.508 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.785 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 94.08 13.83 53.41 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -167.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.2 OUTLIER -81.28 145.14 31.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.219 -0.491 . . . . 0.0 109.877 178.071 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -69.83 143.99 52.72 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -171.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -59.19 107.22 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.042 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.9 169.4 15.25 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -177.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.26 -63.02 1.17 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.874 177.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.435 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . 86.71 142.11 6.92 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.899 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.435 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 2.9 Cg_exo -76.43 -178.06 4.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.995 2.464 . . . . 0.0 111.507 176.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.0 mm . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.24 179.785 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.778 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m 53.91 54.0 10.41 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 122.813 0.445 . . . . 0.0 112.182 176.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.51 -67.16 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 172.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.77 -42.85 17.45 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 173.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.435 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER 62.66 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.105 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.435 ' H ' ' HB ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -101.02 153.28 19.68 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -177.732 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -70.59 120.54 16.36 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -74.53 109.47 8.04 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 121.62 0.724 . . . . 0.0 110.815 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.49 137.12 36.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.445 173.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.434 ' H ' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -65.46 132.57 31.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.742 0.306 . . . . 0.0 110.344 179.696 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.92 176.53 4.93 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.199 -177.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -64.86 -39.65 93.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.513 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -90.82 4.55 81.86 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.351 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -83.75 -172.82 4.36 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 109.926 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.599 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 3.3 p-90 -156.48 -166.8 2.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.4 -75.48 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.188 0.518 . . . . 0.0 109.87 175.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.615 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 44.7 t -142.97 155.24 62.51 Favored Pre-proline 0 C--N 1.319 -0.727 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 174.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.615 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 17.9 Cg_exo -68.42 -14.2 39.41 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.983 1.789 . . . . 0.0 110.975 176.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 21' ' ' LYS . 2.6 t0 -106.59 177.62 4.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.794 177.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.79 -10.94 9.44 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.838 0.352 . . . . 0.0 110.545 -179.075 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 9.0 pttm -85.21 -2.87 58.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.542 177.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.426 ' HA ' ' NH1' ' A' ' 35' ' ' ARG . 44.0 t -119.41 -86.76 0.64 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.568 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 59.64 4.61 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.809 175.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 48.7 t30 -76.21 159.97 30.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.663 0.268 . . . . 0.0 110.723 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -79.85 62.1 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.228 0.537 . . . . 0.0 110.865 178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.439 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 78.7 m-20 -89.53 125.7 35.3 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.409 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -84.15 171.51 12.77 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.03 -51.78 16.54 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -70.1 -12.48 61.63 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.572 ' O ' ' HZ2' ' A' ' 15' ' ' TRP . 0.9 OUTLIER -79.23 86.46 5.0 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 177.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -0.79 12.66 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -142.06 135.39 29.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.75 0.31 . . . . 0.0 111.559 -177.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.439 ' HA ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 t -69.2 138.4 54.02 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.252 0.548 . . . . 0.0 109.886 174.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HA ' HH21 ' A' ' 38' ' ' ARG . 0.8 OUTLIER -100.43 2.52 42.3 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.637 -179.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -104.87 -58.88 1.82 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.317 -174.627 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 24.7 p -93.26 -61.24 1.61 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.192 0.52 . . . . 0.0 111.661 -171.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 36' ' ' CYS . . . -133.5 -86.0 0.27 Allowed Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.879 -175.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.456 HH21 ' HA ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -175.73 -132.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.681 0.24 . . . . 0.0 111.188 -169.175 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.432 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.59 145.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.77 0.828 . . . . 0.0 113.187 -173.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -64.34 104.36 0.76 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.968 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.86 88.44 0.55 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.422 -179.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -135.66 101.86 4.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.027 -178.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -132.11 68.32 0.55 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.963 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -89.68 -177.07 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.62 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.408 ' H ' HG13 ' A' ' 45' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.306 176.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 112.28 -0.328 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 112.94 25.03 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.703 0.287 . . . . 0.0 110.804 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -151.18 96.79 2.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.952 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m 58.1 39.02 26.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.694 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.7 -133.02 0.11 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.424 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.57 155.11 18.04 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.761 0.315 . . . . 0.0 110.665 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.71 113.22 16.58 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.88 93.28 4.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.413 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.437 ' HA ' ' NE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -78.52 105.46 9.8 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 172.046 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.529 HG21 ' HB3' ' A' ' 14' ' ' ASP . 2.1 t -66.95 95.12 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.028 -176.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -15.58 61.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.398 0.618 . . . . 0.0 111.045 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -81.08 -32.4 33.94 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.349 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 118.24 96.6 1.8 Allowed Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.428 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.529 ' HB3' HG21 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -80.53 146.39 31.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.136 0.493 . . . . 0.0 110.039 178.227 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.475 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 8.8 p-90 -136.96 177.91 7.49 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.944 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.811 ' HB ' ' HA2' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -111.88 -108.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.155 -176.675 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.494 ' H ' HD12 ' A' ' 16' ' ' ILE . 4.1 t -134.89 137.62 27.7 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.4 Cg_exo -62.55 -26.69 76.16 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.725 2.283 . . . . 0.0 112.395 -171.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HB3' ' HD3' ' A' ' 20' ' ' LYS . 6.8 t0 -147.1 178.03 8.7 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.554 ' HD3' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER 72.46 150.66 0.1 Allowed 'General case' 0 N--CA 1.432 -1.333 0 CA-C-O 122.123 0.963 . . . . 0.0 110.345 175.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 39.01 0.16 Allowed 'General case' 0 C--N 1.3 -1.556 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.527 172.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.479 ' H ' ' C ' ' A' ' 20' ' ' LYS . 14.2 t -77.2 -78.6 0.12 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.112 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.811 ' HA2' ' HB ' ' A' ' 16' ' ' ILE . . . 70.54 36.93 68.56 Favored Glycine 0 N--CA 1.443 -0.899 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.767 178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 4.8 t30 -70.73 131.2 43.5 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -77.73 99.28 2.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.476 0.655 . . . . 0.0 110.53 -177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.1 m-20 -85.4 151.32 24.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.447 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -48.41 -80.84 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 O-C-N 123.816 0.697 . . . . 0.0 111.56 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -59.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.508 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 0.5 OUTLIER -83.52 52.28 2.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.873 178.748 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.58 ' NH2' ' HA ' ' A' ' 34' ' ' ASP . 0.1 OUTLIER -122.46 117.57 26.29 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.515 174.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -82.69 -3.72 56.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.931 0.396 . . . . 0.0 110.824 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 9.8 m -141.84 154.98 45.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.366 178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.425 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 42.9 t -58.36 136.46 57.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.163 0.506 . . . . 0.0 110.693 177.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.58 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 12.3 t70 -72.63 -11.42 60.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.349 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -108.47 -57.77 2.09 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.989 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.466 ' SG ' ' NZ ' ' A' ' 20' ' ' LYS . 39.8 m -79.14 -37.8 37.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 111.904 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.425 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 85.54 11.45 74.7 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -171.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 133.06 36.43 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.4 OUTLIER -77.07 158.53 30.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.37 -174.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.98 78.7 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.904 172.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -46.71 106.49 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.709 -173.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 120.73 14.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.307 177.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -147.5 -80.76 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.768 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.22 -36.87 77.97 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 122.533 2.155 . . . . 0.0 111.143 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.461 HD13 ' HA ' ' A' ' 45' ' ' ILE . 1.8 mm . . . . . 0 C--O 1.25 1.086 0 CA-C-O 117.76 -1.114 . . . . 0.0 108.594 176.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.535 -0.626 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.83 103.17 3.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 0.0 111.019 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.486 ' H ' ' HG2' ' A' ' 3' ' ' MET . 0.6 OUTLIER -104.08 -12.2 16.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.827 179.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.18 91.1 8.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.933 0.397 . . . . 0.0 110.185 176.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.5 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -77.91 -106.91 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.188 179.442 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' H ' ' HB ' ' A' ' 5' ' ' THR . 4.2 mptt -100.8 48.65 0.9 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.067 0.46 . . . . 0.0 110.825 -176.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -69.65 121.45 17.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.771 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -81.12 59.18 3.77 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.867 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.564 ' O ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -81.51 70.28 8.34 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 172.842 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.564 ' HB ' ' O ' ' A' ' 9' ' ' ARG . 5.4 t 78.25 133.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.919 -176.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.34 156.12 26.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.954 -176.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -72.21 -48.84 39.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.709 -175.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.504 ' O ' ' HA ' ' A' ' 28' ' ' ALA . . . -108.52 33.41 6.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.497 -0.859 . . . . 0.0 113.502 -172.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -64.87 152.86 41.9 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.524 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -129.74 -10.74 4.43 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 122.161 0.981 . . . . 0.0 109.904 -176.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.524 ' HB ' ' O ' ' A' ' 15' ' ' TRP . 7.8 mm 71.11 138.98 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.444 0 CA-C-N 112.751 -2.022 . . . . 0.0 109.642 -172.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 24.7 t -42.66 146.44 0.73 Allowed Pre-proline 0 C--O 1.24 0.561 0 C-N-CA 122.832 0.453 . . . . 0.0 111.999 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.5 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -68.31 -13.78 38.62 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 122.42 2.08 . . . . 0.0 111.379 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -98.18 -178.72 4.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.948 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.1 11.48 11.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.014 0.435 . . . . 0.0 110.567 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.6 pttp -97.97 -24.07 15.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.779 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.644 ' SG ' ' HB3' ' A' ' 35' ' ' ARG . 59.5 m -97.06 -73.11 0.62 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.409 0.623 . . . . 0.0 111.454 178.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 16' ' ' ILE . . . 69.52 37.17 78.06 Favored Glycine 0 N--CA 1.44 -1.047 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 -166.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.96 137.77 58.29 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.534 -0.833 . . . . 0.0 111.568 -176.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -86.62 87.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.018 173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.7 166.76 21.48 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.715 -173.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -65.27 -74.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.742 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.504 ' HA ' ' O ' ' A' ' 13' ' ' GLY . . . -179.09 -76.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.079 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 37.1 mmt-85 -77.45 42.79 0.36 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.067 -178.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.86 135.19 39.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 174.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 1.38 51.7 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.0 0.429 . . . . 0.0 110.504 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.98 155.63 41.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.591 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.53 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 40.7 t -67.78 155.1 40.07 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.5 176.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -17.57 17.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.373 178.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.644 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -88.19 -45.64 9.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.938 -178.323 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -113.45 -55.75 2.48 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.956 178.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.53 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 125.74 8.92 5.05 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.09 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -62.21 137.5 58.27 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 175.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -75.68 153.68 36.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.357 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -58.6 107.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.638 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.31 -63.17 1.11 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.013 0.435 . . . . 0.0 111.482 -176.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.96 -42.76 0.27 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.3 0.571 . . . . 0.0 110.673 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 137.83 -71.85 0.45 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.07 -28.02 41.65 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.157 1.905 . . . . 0.0 110.465 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.881 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.342 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 112.184 -0.367 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.77 42.9 30.27 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.966 0.412 . . . . 0.0 111.794 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.08 -80.23 0.53 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.164 177.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.486 ' HB2' ' H ' ' A' ' 5' ' ' THR . 1.3 m 54.86 -100.67 0.11 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.694 -176.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.486 ' H ' ' HB2' ' A' ' 4' ' ' SER . 0.3 OUTLIER -111.99 1.9 16.64 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.197 0.522 . . . . 0.0 111.062 179.281 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.86 69.41 1.34 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.499 . . . . 0.0 110.506 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 149.59 22.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.178 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.427 ' HZ ' HG11 ' A' ' 25' ' ' VAL . 11.1 t80 59.55 77.45 0.31 Allowed 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.789 0.681 . . . . 0.0 111.865 176.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.591 HH22 ' HE1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -93.29 127.3 38.82 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.0 t -130.99 128.39 62.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -75.66 143.23 42.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.305 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -76.41 148.27 37.42 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.557 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 91.23 -11.98 70.54 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.306 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' A' ' 11' ' ' SER . 14.6 m-20 -71.32 161.79 30.5 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 175.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.507 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 23.5 p-90 -125.03 133.27 53.02 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.535 HG13 ' H ' ' A' ' 17' ' ' CYS . 0.9 OUTLIER -69.7 -55.51 14.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 C-N-CA 120.207 -0.597 . . . . 0.0 109.703 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.535 ' H ' HG13 ' A' ' 16' ' ' ILE . 3.6 m -162.55 168.07 11.21 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.495 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 23.1 Cg_exo -64.74 -35.05 47.99 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.935 1.757 . . . . 0.0 111.19 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.707 ' HB3' ' HG2' ' A' ' 21' ' ' LYS . 29.8 t0 -155.17 163.4 40.25 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.116 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 31.78 0.16 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.937 0.399 . . . . 0.0 111.249 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.707 ' HG2' ' HB3' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -79.12 -38.98 34.8 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 173.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.65 -91.25 0.28 Allowed 'General case' 0 N--CA 1.436 -1.142 0 CA-C-O 121.632 0.729 . . . . 0.0 109.408 170.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.48 64.69 0.45 Allowed Glycine 0 C--N 1.314 -0.685 0 CA-C-N 114.353 -1.294 . . . . 0.0 112.717 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 51.4 t30 -105.8 -173.22 2.25 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.427 HG11 ' HZ ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -121.49 90.31 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.198 0.523 . . . . 0.0 109.676 174.148 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -95.3 167.49 11.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.519 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.691 ' HD2' ' HG2' ' A' ' 29' ' ' ARG . 3.9 t80 -102.22 144.05 31.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.955 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HA ' ' HD1' ' A' ' 15' ' ' TRP . . . -51.11 -34.02 28.81 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.691 ' HG2' ' HD2' ' A' ' 27' ' ' PHE . 0.4 OUTLIER -80.51 -3.84 51.62 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.944 0.402 . . . . 0.0 110.837 -179.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 15.9 mtt-85 -80.42 129.28 34.41 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.13 -12.73 40.24 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.295 0.569 . . . . 0.0 110.646 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -146.16 158.19 43.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.677 -178.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.477 ' SG ' ' HD3' ' A' ' 18' ' ' PRO . 64.6 m -54.82 136.11 47.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.821 171.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -82.93 -41.9 18.32 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.894 0.378 . . . . 0.0 111.71 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -42.79 8.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.087 0.47 . . . . 0.0 110.745 -174.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.94 -57.45 3.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.854 -176.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.456 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 111.31 19.94 7.29 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.487 -0.863 . . . . 0.0 114.638 174.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -91.91 167.37 12.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.853 0.827 . . . . 0.0 109.089 173.049 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 pm0 -96.39 151.86 19.14 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 121.93 -0.482 . . . . 0.0 110.624 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.4 68.9 2.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.149 0.5 . . . . 0.0 110.071 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -72.94 -30.63 64.02 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.767 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.48 107.0 4.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.347 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -137.19 -167.81 11.19 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -75.74 60.35 5.94 Favored 'Trans proline' 0 CA--C 1.53 0.285 0 C-N-CA 123.155 2.57 . . . . 0.0 112.162 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.6 mt . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.517 179.26 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 111.936 -0.466 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.19 86.92 1.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.131 0.491 . . . . 0.0 110.682 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.55 13.91 17.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.04 12.93 14.19 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.925 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.7 m 68.68 104.37 0.05 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.515 -175.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.87 115.13 2.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.876 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.08 164.1 16.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.239 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -65.73 92.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.234 0.54 . . . . 0.0 110.945 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.05 133.35 35.38 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.851 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.41 171.02 3.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.111 179.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.43 142.09 58.05 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.11 157.26 16.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.592 0.711 . . . . 0.0 111.172 -175.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 98.95 -43.83 1.8 Allowed Glycine 0 C--N 1.314 -0.693 0 N-CA-C 110.038 -1.225 . . . . 0.0 110.038 -168.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.47 136.52 33.14 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.712 ' HH2' HH12 ' A' ' 38' ' ' ARG . 6.6 p-90 -127.17 149.48 49.95 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.145 0.498 . . . . 0.0 110.903 -177.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.458 HG22 ' HA ' ' A' ' 25' ' ' VAL . 3.8 pt -98.8 -117.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.72 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.543 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 5.5 t -123.2 149.88 58.58 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 175.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.543 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 46.4 Cg_exo -57.18 -29.99 85.56 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.989 1.792 . . . . 0.0 112.444 -177.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 20' ' ' LYS . 18.7 t70 -110.97 -174.94 2.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.976 -177.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 5.3 mtmm -103.27 -9.95 19.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.161 -174.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mtmm -60.41 -37.8 82.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.112 0.482 . . . . 0.0 110.265 177.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.555 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -88.02 -79.74 0.29 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.509 0.671 . . . . 0.0 110.317 174.593 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.48 27.37 73.55 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -170.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 32.7 t30 -84.19 133.61 34.59 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.014 -0.593 . . . . 0.0 110.677 -176.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.458 ' HA ' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -78.16 92.29 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.482 0.658 . . . . 0.0 110.492 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.522 ' OD1' ' HB2' ' A' ' 34' ' ' ASP . 91.4 m-20 -79.93 -172.88 3.6 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.413 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.798 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 2.2 t80 -73.75 -131.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.814 177.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -140.09 -62.99 0.5 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.95 41.61 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.241 175.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.798 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -111.01 121.48 45.47 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.459 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.69 21.3 8.56 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.604 0.716 . . . . 0.0 109.933 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.2 m -153.99 150.69 28.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.446 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.916 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -63.54 158.5 20.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.404 0.621 . . . . 0.0 111.8 175.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 0.5 OUTLIER -92.9 -18.75 22.4 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.391 174.607 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.555 ' NH2' ' HA ' ' A' ' 22' ' ' CYS . 0.1 OUTLIER -104.44 -68.26 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.678 -175.546 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.726 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 29.5 p -79.91 -30.4 40.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.195 0.521 . . . . 0.0 110.259 -176.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.916 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 87.72 6.68 76.23 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.881 -0.676 . . . . 0.0 113.926 168.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.726 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -73.04 166.85 22.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.633 0.717 . . . . 0.0 110.051 177.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.485 ' O ' ' HD2' ' A' ' 38' ' ' ARG . 20.3 pm0 -74.25 175.69 7.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.515 -177.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -77.52 55.08 1.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.849 0.833 . . . . 0.0 110.555 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.55 117.51 25.37 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.393 178.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.26 20.0 12.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.466 0.65 . . . . 0.0 110.516 -179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.409 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -82.16 143.31 22.89 Favored Glycine 0 N--CA 1.445 -0.755 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.967 176.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.409 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 21.0 Cg_exo -65.83 99.9 0.41 Allowed 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.811 2.341 . . . . 0.0 112.191 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.244 0.792 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.79 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.421 ' O ' ' HB3' ' A' ' 3' ' ' MET . 0.0 OUTLIER -63.85 118.38 8.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.427 0.113 . . . . 0.0 110.857 -178.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 2' ' ' SER . 3.4 tmm? 73.1 -52.69 0.71 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.955 0.785 . . . . 0.0 111.546 178.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.03 78.72 7.82 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.018 0.437 . . . . 0.0 111.254 -178.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.36 6.63 13.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.003 0.43 . . . . 0.0 111.332 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.7 tptt -86.35 65.14 8.92 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 172.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -100.4 -153.33 0.44 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.537 -173.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.411 ' HB3' HG12 ' A' ' 10' ' ' VAL . 87.5 m-85 -87.64 120.26 28.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.941 -175.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 71.28 3.2 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.767 172.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.411 HG12 ' HB3' ' A' ' 8' ' ' PHE . 8.7 p -151.58 25.68 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.499 1.143 . . . . 0.0 108.709 -178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.434 ' HB2' ' H ' ' A' ' 12' ' ' ASP . 2.2 p -102.05 -139.06 0.34 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.599 -174.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.434 ' H ' ' HB2' ' A' ' 11' ' ' SER . 18.2 p-10 -83.95 154.55 23.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 170.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.16 -44.79 3.12 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -170.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -93.25 177.31 6.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 173.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.469 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 39.6 p-90 -160.98 148.43 15.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.705 0.288 . . . . 0.0 110.618 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.0 OUTLIER -99.92 157.12 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 169.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 6.2 m -47.62 144.69 4.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 O-C-N 123.879 0.737 . . . . 0.0 111.916 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' H ' ' A' ' 41' ' ' THR . 11.8 Cg_exo -69.62 -31.59 20.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.551 2.167 . . . . 0.0 113.981 -164.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.438 ' OD1' ' HG2' ' A' ' 20' ' ' LYS . 4.7 t70 -116.04 172.15 7.35 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.139 0.495 . . . . 0.0 111.551 -174.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.438 ' HG2' ' OD1' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -77.95 -25.45 48.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.993 -178.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.3 mmtm -71.24 -16.29 62.49 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.485 0.66 . . . . 0.0 110.005 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 1.041 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 1.2 m -97.2 -85.81 0.35 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.55 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.01 14.24 67.86 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.177 -0.919 . . . . 0.0 113.65 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.764 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 1.7 t30 -80.23 153.65 28.41 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.939 0.399 . . . . 0.0 111.219 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -93.33 106.71 18.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.174 0.512 . . . . 0.0 110.07 174.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.593 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -87.95 176.36 7.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.029 -174.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -61.89 -89.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.401 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.81 -65.14 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.539 ' HD3' ' HA ' ' A' ' 29' ' ' ARG . 3.0 mmt-85 -78.66 56.46 1.85 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.173 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 19.8 mmt-85 -126.43 129.93 49.7 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.599 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.71 -3.21 42.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.488 0.661 . . . . 0.0 109.864 172.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -130.98 166.41 21.05 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.491 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.695 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 85.2 m -56.9 169.48 0.51 Allowed 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.97 0.891 . . . . 0.0 113.176 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 26' ' ' ASN . 3.2 t70 -99.68 -41.35 7.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.44 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.509 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -105.78 -48.01 3.74 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.357 -177.508 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.27 -43.26 42.51 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -171.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.695 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 90.84 37.7 6.32 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.322 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.497 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -100.63 170.45 8.36 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.012 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -91.26 149.47 21.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 172.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -57.28 102.32 0.09 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.133 0.492 . . . . 0.0 111.118 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.562 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -68.06 105.23 1.98 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.932 177.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.23 106.63 6.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.177 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 154.39 -74.01 0.24 Allowed Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.731 -176.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.98 138.69 37.68 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.933 2.422 . . . . 0.0 111.849 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.1 tp . . . . . 0 C--O 1.251 1.17 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -179.897 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 112.217 -0.353 . . . . 0.0 112.217 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.623 ' HA ' HG22 ' A' ' 45' ' ' ILE . 0.7 OUTLIER -71.36 -45.48 62.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.657 0.265 . . . . 0.0 111.525 -178.622 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.65 -73.06 0.32 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.96 142.57 27.15 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 173.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.29 23.97 0.27 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -174.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.1 mttt -99.44 106.9 19.0 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -99.97 166.4 11.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.596 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -78.23 80.7 4.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.28 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -97.77 121.3 39.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.61 175.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.51 HG12 ' H ' ' A' ' 12' ' ' ASP . 10.9 t -62.5 128.7 24.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.961 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -13.14 58.1 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.419 0.628 . . . . 0.0 111.724 -176.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.51 ' H ' HG12 ' A' ' 10' ' ' VAL . 0.4 OUTLIER -74.92 -19.92 59.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.31 177.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 112.96 -12.34 24.61 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.171 178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -82.46 168.24 17.63 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.022 0.439 . . . . 0.0 111.171 -177.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.591 ' HH2' HH12 ' A' ' 38' ' ' ARG . 13.5 p-90 -130.36 171.56 12.81 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -112.16 -101.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.417 -176.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.467 ' SG ' ' NH2' ' A' ' 38' ' ' ARG . 6.5 t -146.1 148.2 34.43 Favored Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 36.0 Cg_exo -62.03 -28.08 80.04 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.113 1.875 . . . . 0.0 111.981 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -87.73 176.94 7.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.661 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.45 -14.16 12.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.137 -176.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -26.87 37.04 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.941 0.401 . . . . 0.0 110.171 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -80.28 -78.44 0.17 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.02 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.25 23.78 74.83 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.943 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 8.9 t30 -65.91 135.47 54.81 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 122.161 0.184 . . . . 0.0 110.579 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.6 m -78.5 96.63 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.545 0.688 . . . . 0.0 109.811 176.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.763 HD21 ' HA ' ' A' ' 33' ' ' CYS . 5.3 m-80 -83.28 -174.46 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.126 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -76.64 -135.59 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.612 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -134.03 -50.46 0.82 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 ptt180 -87.56 13.4 10.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.907 175.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.96 125.79 29.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.023 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -90.89 -8.92 48.06 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.034 0.445 . . . . 0.0 110.507 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.2 149.33 50.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.808 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.763 ' HA ' HD21 ' A' ' 26' ' ' ASN . 2.9 t -62.59 160.62 13.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.028 176.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -100.76 -26.15 13.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.78 -64.98 1.03 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.079 -176.172 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 38' ' ' ARG . 21.5 p -80.58 -40.07 26.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.596 -176.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.65 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.48 7.95 47.57 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.679 -0.772 . . . . 0.0 114.153 169.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.732 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -79.32 169.69 17.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.294 0.547 . . . . 0.0 110.941 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -90.05 155.84 18.8 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.89 0.376 . . . . 0.0 110.791 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -76.72 107.44 9.03 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.853 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.18 -35.15 79.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.845 178.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 63.92 53.91 1.83 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.992 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -106.09 114.46 4.48 Favored Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 174.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.01 -33.52 19.23 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.348 2.032 . . . . 0.0 112.632 -177.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.623 HG22 ' HA ' ' A' ' 2' ' ' SER . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.454 -176.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.583 0 N-CA-C 112.094 -0.402 . . . . 0.0 112.094 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.0 88.35 4.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.967 0.413 . . . . 0.0 110.706 178.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.91 -62.57 1.29 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.513 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.39 29.16 3.01 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.235 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.59 118.13 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.505 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -100.45 179.58 4.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.1 175.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -83.31 174.32 10.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.758 0.313 . . . . 0.0 110.439 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -81.75 9.37 8.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.599 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.88 131.97 47.53 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.948 0.404 . . . . 0.0 110.059 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 t -80.77 132.7 31.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.087 0.47 . . . . 0.0 110.487 -176.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.58 154.69 19.79 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.629 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.56 141.01 29.2 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 87.86 23.43 38.73 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 -171.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 14.5 p-10 -94.45 -172.81 2.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.292 -0.954 . . . . 0.0 111.511 -175.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CD2' ' HE2' ' A' ' 40' ' ' LYS . 12.1 p-90 -155.59 171.79 19.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.411 177.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -112.74 153.43 14.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 171.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.843 ' SG ' ' HB3' ' A' ' 24' ' ' ASN . 92.7 m -42.03 146.14 0.67 Allowed Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.372 1.045 . . . . 0.0 112.516 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HA ' HG23 ' A' ' 42' ' ' THR . 31.4 Cg_exo -58.7 -28.04 85.21 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.94 2.427 . . . . 0.0 113.707 -172.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -121.24 177.17 5.27 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.162 0.506 . . . . 0.0 111.578 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.35 -27.43 19.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.185 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -70.32 -24.34 62.99 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 174.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -80.56 -82.43 0.12 Allowed 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.492 171.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 52.96 47.66 59.36 Favored Glycine 0 CA--C 1.524 0.625 0 CA-C-N 115.353 -0.84 . . . . 0.0 114.913 174.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.843 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 3.3 t30 -105.66 155.61 19.07 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 117.075 0.438 . . . . 0.0 110.847 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.422 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.3 OUTLIER -85.2 110.12 19.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.916 173.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -88.69 160.78 17.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.401 -177.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -51.72 -76.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.652 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.414 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 179.67 -80.76 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.711 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.22 51.88 1.89 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.228 0.537 . . . . 0.0 110.381 179.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -108.31 128.49 54.79 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.419 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.97 7.22 43.15 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.963 0.411 . . . . 0.0 110.913 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.77 156.27 44.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.726 177.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.25 153.69 11.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 175.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -100.86 -7.93 23.07 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -169.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -147.89 -36.89 0.2 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -172.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -124.55 -29.4 3.48 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -160.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -121.72 -109.73 2.1 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.196 -1.002 . . . . 0.0 113.514 -170.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.423 ' HB3' ' H ' ' A' ' 39' ' ' GLU . 2.9 mmt180 -171.19 -156.56 0.12 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.391 0.139 . . . . 0.0 110.979 -171.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.423 ' H ' ' HB3' ' A' ' 38' ' ' ARG . 0.1 OUTLIER -44.9 148.63 0.52 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.457 ' HE2' ' CD2' ' A' ' 15' ' ' TRP . 35.0 tttm -59.59 92.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.945 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -5.21 59.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.305 -178.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.452 HG23 ' HA ' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -80.6 -11.6 59.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.0 178.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 89.43 -149.78 20.85 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.527 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -74.86 -155.16 0.04 OUTLIER 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 123.178 2.586 . . . . 0.0 112.024 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.8 mm . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.129 -0.939 . . . . 0.0 109.619 176.847 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 111.786 -0.526 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.93 4.49 47.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.004 0.43 . . . . 0.0 111.243 -178.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.04 59.42 5.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.117 0.484 . . . . 0.0 110.802 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.62 -63.58 0.45 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.468 176.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.63 73.76 2.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.118 0.485 . . . . 0.0 110.636 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.91 21.21 14.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.384 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -80.84 -34.4 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.13 -175.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -105.3 109.11 20.97 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.711 -177.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.58 36.12 1.01 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.62 0.724 . . . . 0.0 109.465 176.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -143.24 168.28 12.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.723 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.8 -168.34 0.45 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -176.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.7 -55.98 5.98 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.301 -173.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -87.58 -6.52 76.98 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.111 -176.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.69 159.86 27.78 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.558 ' CE2' ' HG3' ' A' ' 40' ' ' LYS . 12.5 p-90 -161.07 164.18 30.97 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.983 0.421 . . . . 0.0 111.213 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pt -115.31 159.53 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 36.8 t -46.28 141.0 5.03 Favored Pre-proline 0 C--O 1.236 0.373 0 O-C-N 123.744 0.653 . . . . 0.0 111.669 -176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.557 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 7.6 Cg_exo -76.79 -10.56 18.37 Favored 'Trans proline' 0 N--CA 1.446 -1.299 0 C-N-CA 122.02 1.813 . . . . 0.0 111.435 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -106.46 160.64 15.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.653 -174.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -96.25 20.05 10.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.236 -176.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.76 -35.75 12.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.065 0.459 . . . . 0.0 109.8 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.1 m -99.28 -79.26 0.49 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.526 0.679 . . . . 0.0 111.475 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.73 21.72 76.23 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.73 -1.748 . . . . 0.0 108.73 -165.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.514 HD21 ' HB2' ' A' ' 34' ' ' ASP . 6.1 t30 -64.41 144.43 57.17 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 113.507 -1.347 . . . . 0.0 110.525 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -87.64 99.14 8.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.375 0.607 . . . . 0.0 109.8 174.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.55 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 3.5 m120 -78.7 163.2 25.62 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.816 -176.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.28 -85.24 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.556 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.412 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . 179.98 -58.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 7.4 mmm180 -78.11 31.74 0.18 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.62 175.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' H ' ' C ' ' A' ' 28' ' ' ALA . 63.6 mmt-85 -98.53 121.35 40.36 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.225 -176.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.69 -5.55 51.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.118 0.485 . . . . 0.0 110.435 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.1 m -142.82 168.1 20.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.331 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.841 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 17.2 t -63.06 156.93 23.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.593 0.711 . . . . 0.0 111.585 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.514 ' HB2' HD21 ' A' ' 24' ' ' ASN . 3.8 m-20 -96.11 -9.78 29.91 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.142 176.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -110.89 -59.85 1.91 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.829 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.0 p -94.52 -55.12 3.26 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.192 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.841 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.71 9.03 4.08 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.505 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -64.19 149.78 47.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.927 0.364 . . . . 0.0 110.439 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.43 155.74 37.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.615 0.245 . . . . 0.0 111.003 -175.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.558 ' HG3' ' CE2' ' A' ' 15' ' ' TRP . 17.4 tttm -64.17 90.39 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.501 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.03 47.03 1.45 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.338 -176.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.423 ' OG1' ' HG2' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -85.36 56.97 4.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.78 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -138.43 -103.97 0.62 Allowed Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -87.67 110.49 0.72 Allowed 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.551 2.167 . . . . 0.0 111.42 173.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.886 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.301 -178.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.2 70.92 10.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.053 0.454 . . . . 0.0 110.601 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.8 ttp -83.71 64.87 8.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 110.37 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.09 179.47 4.26 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.404 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 12.3 t -147.45 -166.2 2.45 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 177.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.01 68.41 10.05 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 177.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -51.34 112.65 0.78 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.426 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.48 178.98 2.69 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.552 0.691 . . . . 0.0 110.888 -176.318 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.79 45.11 1.12 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.137 -177.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.502 HG22 ' HB3' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -120.28 12.55 6.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.236 178.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.08 50.47 1.09 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.439 0.638 . . . . 0.0 111.082 -177.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.37 -143.57 0.06 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.008 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -86.44 10.89 65.17 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.68 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . 4.2 m-20 -95.01 -172.63 2.74 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.528 ' HD1' ' HA ' ' A' ' 28' ' ' ALA . 6.4 p-90 -145.66 153.84 41.45 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 176.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.8 -80.02 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 176.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 4.6 m -149.92 151.67 32.75 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.647 -179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 10.0 Cg_exo -75.18 -17.9 18.78 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.82 2.347 . . . . 0.0 112.433 -175.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.459 ' HB3' ' HB2' ' A' ' 22' ' ' CYS . 42.5 t0 -122.82 162.63 21.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.95 -170.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -15.97 32.76 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 175.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.2 mttp -90.55 6.58 43.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.668 174.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.731 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -98.24 -89.53 0.3 Allowed 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.05 179.099 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.476 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 72.38 55.7 6.69 Favored Glycine 0 CA--C 1.521 0.451 0 CA-C-N 115.18 -0.918 . . . . 0.0 114.35 173.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.611 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 18.6 t30 -123.79 167.64 13.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 173.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.0 104.63 17.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.965 0.412 . . . . 0.0 110.142 176.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -102.05 178.6 4.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.117 0.484 . . . . 0.0 111.628 -174.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.457 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -100.88 135.77 41.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.106 177.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.722 ' HB2' ' HA ' ' A' ' 14' ' ' ASP . . . -47.05 -51.59 17.09 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.213 0.605 . . . . 0.0 112.605 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 29' ' ' ARG . 4.1 ptt180 -69.74 -16.13 63.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.541 -177.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.2 mmt180 -74.36 133.98 42.49 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.8 2.22 40.95 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.933 0.397 . . . . 0.0 110.651 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.496 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -133.76 150.16 51.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.351 -178.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.54 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 34.0 m -70.04 145.48 51.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.927 175.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -83.97 -45.37 13.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.642 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ARG . 9.2 mmt180 -91.73 -48.46 6.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.049 0.452 . . . . 0.0 111.498 -174.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -45.36 24.67 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.203 -173.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.59 23.01 14.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.798 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.54 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -96.0 -164.04 1.11 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 174.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.496 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 5.0 mp0 -125.26 158.48 33.99 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 ttpt -72.47 74.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.106 0.479 . . . . 0.0 110.869 179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 p -78.84 -63.7 1.35 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.289 0.566 . . . . 0.0 110.362 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.449 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -102.3 110.69 22.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.018 -179.024 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.45 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -142.16 121.9 1.89 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 121.152 -0.547 . . . . 0.0 111.886 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.45 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 5.8 Cg_exo -78.97 61.79 8.26 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.039 2.493 . . . . 0.0 112.288 -178.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 35.9 mt . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.124 179.007 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.27 -24.32 14.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.668 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ttp -105.52 111.17 23.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.812 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.67 118.67 33.63 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 173.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.6 m 68.94 127.39 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.689 0.618 . . . . 0.0 110.342 -170.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.15 108.85 0.74 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.979 0.419 . . . . 0.0 111.101 -177.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 p30 -97.89 17.9 17.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.179 0.514 . . . . 0.0 110.536 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.31 71.79 3.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.296 178.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.81 77.73 2.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.457 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.3 p -61.66 103.14 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-O 121.702 0.763 . . . . 0.0 109.877 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.28 164.05 20.32 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.54 -175.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.6 155.76 25.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.112 0.482 . . . . 0.0 110.546 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.2 15.63 60.39 Favored Glycine 0 C--N 1.318 -0.455 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 -168.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -83.09 174.33 10.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.897 -1.152 . . . . 0.0 111.686 -175.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.509 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 24.1 p-90 -160.09 153.94 22.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.325 173.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.08 156.48 8.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 174.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.426 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . 3.7 t -43.85 143.72 1.64 Allowed Pre-proline 0 C--O 1.235 0.329 0 O-C-N 123.778 0.674 . . . . 0.0 111.124 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.509 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 24.6 Cg_exo -63.55 -20.44 69.53 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.376 2.051 . . . . 0.0 112.278 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -111.65 149.58 31.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.449 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.22 -1.74 50.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.392 -174.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.9 mttp -76.29 -15.29 60.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.402 0.62 . . . . 0.0 110.053 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.76 ' HB2' HH21 ' A' ' 38' ' ' ARG . 0.1 OUTLIER -110.3 -82.39 0.57 Allowed 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.705 178.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.75 17.68 80.06 Favored Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.294 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.839 ' HB2' ' HD3' ' A' ' 35' ' ' ARG . 14.9 t30 -62.59 134.7 56.75 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.843 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -80.05 90.24 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.674 0.75 . . . . 0.0 110.363 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -79.61 112.93 17.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.917 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -19.52 -79.5 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 O-C-N 125.102 1.501 . . . . 0.0 113.997 -175.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -176.5 -64.73 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.08 41.35 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.519 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.6 mmt-85 -108.82 104.89 14.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.575 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.92 -10.91 59.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.271 0.557 . . . . 0.0 111.187 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -141.38 146.71 36.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.834 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.796 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 31.0 t -56.99 145.66 29.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.008 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -89.11 -15.96 32.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.175 176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.839 ' HD3' ' HB2' ' A' ' 24' ' ' ASN . 3.6 ttp180 -95.15 -44.01 7.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.417 -176.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.585 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 15.3 p -127.31 -26.31 3.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.796 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 100.25 14.38 33.36 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.555 179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.76 HH21 ' HB2' ' A' ' 22' ' ' CYS . 2.9 tpp180 -60.92 143.81 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.862 0.363 . . . . 0.0 110.693 176.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.44 155.71 39.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -72.59 67.3 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.975 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.3 129.26 42.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.785 178.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.66 124.24 42.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.816 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 139.24 -157.09 24.84 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.295 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -62.58 107.92 0.66 Allowed 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.144 2.563 . . . . 0.0 112.803 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.245 0.851 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.385 175.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.799 0 N-CA-C 111.636 -0.586 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.15 -164.72 1.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.78 102.98 0.82 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.676 0.274 . . . . 0.0 110.407 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.81 20.39 7.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.209 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m 60.55 44.02 12.19 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.53 -177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.6 39.21 1.03 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.833 -179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -87.24 95.95 10.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.425 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.3 t80 50.23 51.3 17.01 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.729 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.414 HH11 ' HA ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -81.54 93.38 6.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.481 -175.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -89.86 104.55 15.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 171.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.8 -167.18 1.54 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.309 0.576 . . . . 0.0 112.001 -172.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -72.98 -46.68 50.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.816 -174.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -94.83 12.94 68.02 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.611 -175.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -76.12 163.06 27.48 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.845 0.355 . . . . 0.0 110.19 -179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.481 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 1.1 p-90 -133.35 -167.06 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.266 -170.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.498 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 0.6 OUTLIER -122.36 -60.17 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.635 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 47.6 t -177.9 155.31 1.03 Allowed Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.635 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 23.1 Cg_exo -66.28 -13.48 40.04 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 121.967 1.778 . . . . 0.0 111.902 172.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -101.68 -173.61 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.794 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 -6.56 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.628 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -93.47 2.9 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.221 0.534 . . . . 0.0 110.012 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.488 ' HA ' HH21 ' A' ' 35' ' ' ARG . 5.8 t -104.21 -81.62 0.52 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.355 -179.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.87 50.77 17.38 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.497 -0.858 . . . . 0.0 110.978 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.498 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 25.0 t30 -81.08 177.3 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.28 -0.46 . . . . 0.0 109.837 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.49 91.38 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.221 0.534 . . . . 0.0 110.204 175.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.778 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.78 151.97 25.0 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.284 0.564 . . . . 0.0 110.568 -179.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 1.9 t80 -81.64 148.03 29.25 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.134 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -43.26 -42.52 4.42 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.844 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -78.28 2.84 17.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.854 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 2.8 mmm180 -97.3 118.3 33.45 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 175.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -5.67 59.2 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.612 -177.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -140.62 159.94 41.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.478 -178.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HA ' HD22 ' A' ' 26' ' ' ASN . 53.2 t -60.74 144.24 52.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.971 0.415 . . . . 0.0 109.901 175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.481 ' HB2' HD21 ' A' ' 24' ' ' ASN . 0.2 OUTLIER -84.82 -8.42 58.81 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.488 HH21 ' HA ' ' A' ' 22' ' ' CYS . 0.3 OUTLIER -106.67 -52.84 2.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.171 178.801 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 86.1 m -78.73 -39.24 36.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.674 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.68 9.98 85.74 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.625 -0.797 . . . . 0.0 111.55 -175.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -88.94 143.12 27.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 pm0 -70.66 156.2 39.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.945 0.402 . . . . 0.0 111.377 -176.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.39 110.16 1.36 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.711 173.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.79 -27.43 66.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.0 m -118.3 89.97 3.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.497 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.501 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -112.85 123.13 6.11 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.137 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.501 ' HD3' ' HA2' ' A' ' 43' ' ' GLY . 2.1 Cg_endo -81.71 66.64 8.49 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 123.44 2.76 . . . . 0.0 111.653 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.483 ' H ' HG13 ' A' ' 45' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.799 0 CA-C-O 118.597 -0.716 . . . . 0.0 110.372 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.823 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.531 ' HB2' ' H ' ' A' ' 3' ' ' MET . 0.4 OUTLIER 49.06 -106.66 0.2 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.297 0.639 . . . . 0.0 112.005 179.487 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.531 ' H ' ' HB2' ' A' ' 2' ' ' SER . 0.0 OUTLIER -123.14 146.09 48.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.728 0.299 . . . . 0.0 110.483 -179.197 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 49.28 1.77 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.064 -178.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.56 -56.54 9.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.918 0.389 . . . . 0.0 111.535 -177.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.67 25.48 3.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.049 0.452 . . . . 0.0 110.69 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -78.47 -23.49 46.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.527 0.679 . . . . 0.0 110.139 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.603 ' HE1' HG11 ' A' ' 25' ' ' VAL . 0.2 OUTLIER -135.93 -160.47 1.06 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.179 177.357 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.447 ' HG3' ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -101.25 122.4 43.59 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.953 179.376 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 t -87.34 81.41 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 171.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.453 ' HB2' ' H ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -82.63 -136.05 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.343 -171.191 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.453 ' H ' ' HB2' ' A' ' 11' ' ' SER . 0.4 OUTLIER -74.38 -68.17 0.55 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.999 -171.583 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.556 ' O ' ' HA ' ' A' ' 28' ' ' ALA . . . -82.95 -11.99 80.42 Favored Glycine 0 C--O 1.225 -0.452 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.787 -173.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -69.55 101.37 1.6 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.858 0.361 . . . . 0.0 110.217 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.696 ' CZ3' ' HG3' ' A' ' 40' ' ' LYS . 50.9 p-90 -107.85 165.87 11.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.463 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.521 ' O ' ' HE3' ' A' ' 15' ' ' TRP . 1.1 pp -106.32 150.48 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.762 175.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 56.7 m -41.09 150.42 0.31 Allowed Pre-proline 0 CA--C 1.537 0.447 0 O-C-N 124.45 1.094 . . . . 0.0 113.314 -177.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.974 ' HG3' ' HA ' ' A' ' 40' ' ' LYS . 34.3 Cg_exo -59.25 -31.12 94.63 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 123.368 2.712 . . . . 0.0 113.822 -174.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -114.91 167.88 10.4 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.015 0.436 . . . . 0.0 111.462 -173.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.85 -36.42 49.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.485 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -30.23 71.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.685 175.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.865 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -76.94 -83.72 0.07 Allowed 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.852 177.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.481 ' N ' ' HB2' ' A' ' 17' ' ' CYS . . . 51.75 40.22 48.43 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.2 -0.909 . . . . 0.0 114.559 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.848 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 5.3 t30 -100.47 158.22 16.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 117.218 0.509 . . . . 0.0 109.944 176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.603 HG11 ' HE1' ' A' ' 8' ' ' PHE . 0.8 OUTLIER -87.25 120.82 37.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.239 0.542 . . . . 0.0 110.579 177.5 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -103.31 177.47 4.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.545 -177.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.832 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 19.6 t80 -62.67 -93.38 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.702 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 13' ' ' GLY . . . -163.42 -79.88 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.48 42.22 0.88 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.519 0.676 . . . . 0.0 110.591 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.832 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -92.11 138.99 31.07 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.761 177.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -31.7 18.55 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.728 0.299 . . . . 0.0 110.845 177.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.765 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -114.74 159.15 20.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.085 0.469 . . . . 0.0 112.07 -175.365 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -59.63 159.08 8.98 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.022 175.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.39 -21.54 17.12 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.876 -170.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 -142.71 -30.73 0.53 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.35 -16.34 2.75 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 -158.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' SG ' ' A' ' 33' ' ' CYS . . . -139.96 -112.61 1.01 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 119.28 -1.438 . . . . 0.0 114.596 -172.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.95 -160.03 0.77 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.669 -0.265 . . . . 0.0 110.61 -167.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.765 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.7 mt-10 -64.51 149.5 48.52 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.974 ' HA ' ' HG3' ' A' ' 18' ' ' PRO . 1.7 tttm -65.49 107.46 1.69 Allowed 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.795 -177.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.498 ' H ' ' HB3' ' A' ' 18' ' ' PRO . 2.8 p -80.99 162.12 23.98 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.125 -178.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.02 106.35 18.33 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.884 174.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -87.55 -143.42 8.35 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.516 -176.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.74 -5.68 14.84 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 123.102 2.535 . . . . 0.0 112.194 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.861 -0.59 . . . . 0.0 109.991 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.923 0 N-CA-C 111.944 -0.462 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.37 90.01 7.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.702 0.287 . . . . 0.0 111.275 -175.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.77 20.76 12.22 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.969 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.96 -52.39 4.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.117 0.484 . . . . 0.0 110.597 178.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.87 141.76 35.58 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.565 178.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 6' ' ' LYS . 5.3 mmtt -100.71 154.74 18.36 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.449 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.81 131.91 46.47 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.564 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.429 ' HB2' ' H ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -148.81 -158.54 0.93 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 176.247 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' H ' ' HB2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -100.29 85.39 2.98 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.102 0.477 . . . . 0.0 110.202 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.1 p -119.87 135.83 58.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.354 -178.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.8 m -98.39 75.43 2.23 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.854 0.835 . . . . 0.0 110.045 175.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -102.57 -121.45 0.18 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.707 -176.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.65 30.2 10.47 Favored Glycine 0 CA--C 1.508 -0.406 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -80.86 -169.01 2.0 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.464 -0.868 . . . . 0.0 111.521 -176.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.508 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 33.4 p-90 -151.02 167.4 27.76 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -122.1 148.65 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.728 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 24' ' ' ASN . 4.0 m -39.61 141.67 0.7 Allowed Pre-proline 0 C--O 1.239 0.543 0 O-C-N 124.27 0.981 . . . . 0.0 113.095 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.508 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 31.2 Cg_exo -61.21 -25.04 80.15 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.426 2.084 . . . . 0.0 111.818 -176.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 21' ' ' LYS . 12.2 t70 -112.47 123.67 50.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.827 178.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.04 11.45 2.73 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -170.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.0 OUTLIER -76.51 -30.05 57.04 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.28 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.8 ' HA ' HH21 ' A' ' 35' ' ' ARG . 53.2 t -96.31 -70.03 0.73 Allowed 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.11 52.07 53.59 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.469 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 t30 -87.41 150.7 23.62 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.511 -0.344 . . . . 0.0 110.094 -177.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.88 88.08 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.183 0.516 . . . . 0.0 110.112 177.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.886 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -79.25 118.45 21.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.628 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -18.63 -82.49 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 O-C-N 125.13 1.518 . . . . 0.0 113.918 -170.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 179.45 -50.26 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -89.28 23.63 2.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.632 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 32' ' ' SER . 0.6 OUTLIER -96.58 115.54 27.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.446 178.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.94 -1.35 52.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 175.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -145.42 163.98 32.94 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.551 178.317 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 1.002 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 25.2 t -64.58 167.97 6.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.81 0.814 . . . . 0.0 112.018 175.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.0 -4.87 26.67 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.547 170.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.8 HH21 ' HA ' ' A' ' 22' ' ' CYS . 1.0 OUTLIER -123.95 -66.72 0.97 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.871 -177.434 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 25.9 p -80.0 -23.49 41.51 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.064 0.459 . . . . 0.0 110.636 -175.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 1.002 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 78.0 7.56 87.53 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.406 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.512 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -66.58 140.01 57.93 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.85 143.2 32.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.262 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -63.32 96.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.701 -178.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.83 115.02 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.642 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.91 115.76 30.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -173.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.415 ' HA3' ' HD3' ' A' ' 44' ' ' PRO . . . -174.08 -94.9 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.278 -0.729 . . . . 0.0 111.278 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.415 ' HD3' ' HA3' ' A' ' 43' ' ' GLY . 12.4 Cg_exo -71.28 -21.18 27.1 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.845 2.363 . . . . 0.0 111.084 172.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.264 0 CA-C-O 117.601 -1.19 . . . . 0.0 108.627 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.85 0 N-CA-C 112.312 -0.315 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.95 129.67 53.3 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.87 47.56 23.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.092 0.472 . . . . 0.0 111.069 -179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -143.54 102.35 3.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.522 -178.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.522 ' HB ' ' H ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -81.12 -105.48 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.522 ' H ' ' HB ' ' A' ' 5' ' ' THR . 6.1 mttt -101.27 166.58 10.69 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -91.11 83.54 5.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.141 0.496 . . . . 0.0 109.797 176.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.55 39.94 0.97 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.098 -177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' HA ' ' NE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -85.8 73.58 10.35 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.088 0.47 . . . . 0.0 110.222 179.266 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.5 t -78.56 105.79 8.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.08 171.35 12.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.889 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -81.69 144.83 30.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 174.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 94.99 -33.84 5.15 Favored Glycine 0 C--N 1.312 -0.788 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -171.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.33 146.08 54.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 174.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.483 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 14.1 p-90 -152.09 154.18 35.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.096 0.474 . . . . 0.0 111.134 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -109.96 160.71 8.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.485 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 9.2 t -45.99 144.24 3.0 Favored Pre-proline 0 N--CA 1.463 0.192 0 O-C-N 123.809 0.693 . . . . 0.0 111.12 -178.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.485 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 18.9 Cg_exo -66.56 -2.63 7.71 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.41 2.074 . . . . 0.0 112.464 -177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -112.33 163.98 13.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.977 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.81 -21.39 16.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.993 179.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.444 ' HG2' ' N ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -68.86 -29.53 67.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.361 0.6 . . . . 0.0 110.007 177.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.444 ' N ' ' HG2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -90.18 -83.01 0.26 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.102 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 22' ' ' CYS . . . 71.21 35.28 64.03 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -175.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -67.43 144.29 55.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.325 -0.437 . . . . 0.0 110.136 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -91.83 87.54 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.602 0.715 . . . . 0.0 111.021 178.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.448 ' ND2' ' HA ' ' A' ' 33' ' ' CYS . 0.7 OUTLIER -79.82 118.54 21.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.463 178.271 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -34.81 -75.13 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 124.125 0.891 . . . . 0.0 112.697 -177.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 176.69 -47.67 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -174.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.723 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -88.88 77.09 7.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 175.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 30' ' ' ARG . 2.0 mmt85 -151.79 117.88 5.55 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.13 -1.395 . . . . 0.0 108.688 -176.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.434 ' HA ' ' HD3' ' A' ' 40' ' ' LYS . 0.2 OUTLIER -96.33 -7.41 35.33 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.276 0.56 . . . . 0.0 110.667 -179.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -147.41 173.03 13.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.503 174.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.823 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 8.0 t -65.82 154.43 39.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.278 0.561 . . . . 0.0 111.564 176.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.53 -9.34 22.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.172 173.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -101.0 -69.4 0.78 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.077 -177.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.465 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 28.5 p -91.21 -34.88 14.81 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.059 -174.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.823 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 105.39 7.25 37.66 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.28 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.465 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -57.95 140.53 51.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.027 0.441 . . . . 0.0 110.711 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.0 pm0 -72.75 171.11 13.22 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.844 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' A' ' 31' ' ' THR . 0.0 OUTLIER -76.33 58.92 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.242 0.544 . . . . 0.0 109.898 176.544 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 135.78 37.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.287 -177.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.8 -42.53 21.55 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.705 -179.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -120.51 124.39 5.88 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 178.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.01 127.6 25.66 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.07 2.514 . . . . 0.0 112.839 -178.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.9 mp . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.392 -0.813 . . . . 0.0 109.827 179.579 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.696 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.06 106.28 18.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.896 0.379 . . . . 0.0 110.338 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.18 139.31 22.18 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.262 -179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.74 124.72 25.41 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.425 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -27.05 68.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.745 -178.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -73.06 -54.4 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.013 0.435 . . . . 0.0 110.575 178.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -91.82 66.64 5.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.996 -176.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -86.71 51.82 2.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.732 176.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 68.32 10.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.634 -174.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.1 121.96 18.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 172.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.27 -136.96 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.318 0.58 . . . . 0.0 112.162 -169.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.95 -37.29 8.71 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.025 -178.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.13 -6.21 52.04 Favored Glycine 0 CA--C 1.521 0.437 0 CA-C-N 115.049 -0.978 . . . . 0.0 113.977 -176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -99.35 -175.45 3.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.096 0.448 . . . . 0.0 110.188 178.394 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.518 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 29.2 p-90 -160.39 157.26 27.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.624 0.25 . . . . 0.0 110.716 -176.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.8 pt -102.23 158.26 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 175.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 5.8 t -45.68 144.21 2.72 Favored Pre-proline 0 C--O 1.236 0.379 0 O-C-N 123.554 0.534 . . . . 0.0 111.806 -177.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.518 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 12.5 Cg_exo -72.67 1.52 6.24 Favored 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.023 2.482 . . . . 0.0 112.297 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.87 160.16 33.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.663 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.4 mptt -89.28 -19.93 24.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.831 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.703 ' HB2' HH22 ' A' ' 38' ' ' ARG . 31.3 mttt -62.42 -22.53 66.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.132 0.491 . . . . 0.0 110.874 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -101.91 -86.35 0.42 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.427 -179.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.4 26.3 57.45 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.371 -174.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 7.8 t30 -80.02 134.86 36.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.591 -0.305 . . . . 0.0 110.924 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -79.66 114.78 20.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.976 0.417 . . . . 0.0 109.885 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.42 158.11 17.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.383 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.499 ' O ' ' HB3' ' A' ' 14' ' ' ASP . 35.2 t80 -53.3 -77.7 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 O-C-N 123.572 0.545 . . . . 0.0 112.055 -175.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -178.34 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.122 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -71.39 24.37 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.774 177.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 32' ' ' SER . 11.7 mmt-85 -90.51 122.55 33.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.174 -177.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.49 -17.52 24.39 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.355 0.598 . . . . 0.0 109.631 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 39' ' ' GLU . 50.8 m -132.35 168.41 18.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.397 174.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.484 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 3.0 t -64.0 164.51 10.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.937 0.875 . . . . 0.0 113.112 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -101.0 -24.69 14.28 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.096 -1.411 . . . . 0.0 109.213 170.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -92.58 -58.38 2.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.509 -171.292 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.516 ' SG ' ' HB2' ' A' ' 38' ' ' ARG . 31.2 p -93.65 -57.16 2.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.948 0.404 . . . . 0.0 110.753 -175.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.484 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 127.94 0.28 6.55 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.739 -178.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.703 HH22 ' HB2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.97 142.57 55.94 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.087 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.5 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 2.0 pm0 -87.63 172.87 9.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.416 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.66 67.86 0.8 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.858 178.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.3 t -80.32 -34.65 36.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.635 -175.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -60.97 1.95 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.762 0.315 . . . . 0.0 110.722 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 152.26 -136.18 5.31 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.741 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -84.8 0.98 8.81 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.726 2.284 . . . . 0.0 112.331 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.2 mt . . . . . 0 C--O 1.25 1.083 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -179.631 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 112.255 -0.338 . . . . 0.0 112.255 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.525 ' O ' ' HB2' ' A' ' 3' ' ' MET . 0.0 OUTLIER -84.38 162.83 19.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.09 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.525 ' HB2' ' O ' ' A' ' 2' ' ' SER . 0.0 OUTLIER 79.67 -30.03 0.14 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.782 0.833 . . . . 0.0 112.025 176.854 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.23 106.35 3.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.374 178.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.25 107.88 18.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.709 178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -20.87 22.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.872 0.368 . . . . 0.0 110.575 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -78.34 131.05 36.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.053 179.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.15 101.68 1.9 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.2 0.524 . . . . 0.0 110.214 178.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.16 78.82 1.77 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.434 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.96 102.5 3.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -80.46 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.604 0.716 . . . . 0.0 110.544 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -102.28 -149.53 0.39 Allowed 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.259 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.59 -123.06 4.78 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 111.278 -0.729 . . . . 0.0 111.278 -178.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.679 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 7.9 t70 -85.73 -62.29 1.56 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.635 0.731 . . . . 0.0 109.978 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.465 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 7.5 p-90 -160.16 161.24 33.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.339 -1.3 . . . . 0.0 107.743 -178.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -108.41 -75.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.781 177.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 1.5 m -147.53 152.67 42.35 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.736 ' HB3' HG22 ' A' ' 41' ' ' THR . 17.4 Cg_exo -68.87 -30.01 27.36 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 123.036 2.491 . . . . 0.0 113.425 -175.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -127.9 -175.2 3.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.054 0.454 . . . . 0.0 111.867 -173.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -93.13 -29.92 15.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.841 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -4.06 33.85 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.742 174.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.859 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -88.38 -85.33 0.19 Allowed 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.752 175.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.65 75.36 Favored Glycine 0 CA--C 1.518 0.253 0 CA-C-N 114.761 -1.109 . . . . 0.0 114.256 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 17.4 t30 -92.41 158.03 16.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 0.0 110.358 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.06 94.46 4.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.482 177.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -93.18 164.42 13.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.928 0.394 . . . . 0.0 110.613 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.453 ' HB3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 t80 -83.91 -92.58 0.08 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.469 -173.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.679 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . . . -166.09 -62.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.247 -173.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -81.01 21.61 0.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.221 0.534 . . . . 0.0 110.599 177.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' HB3' ' A' ' 27' ' ' PHE . 6.0 mtp85 -90.89 114.7 27.22 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.92 -0.67 57.28 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.264 0.554 . . . . 0.0 110.634 177.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -146.15 153.75 41.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.118 177.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.468 ' HB2' ' H ' ' A' ' 38' ' ' ARG . 88.4 m -59.13 143.43 48.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.598 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.412 ' HB3' HD21 ' A' ' 24' ' ' ASN . 17.9 t70 -75.1 -37.66 61.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.995 176.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.21 -56.06 2.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.383 -175.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.46 -21.03 49.68 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.472 -173.505 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.462 ' N ' ' HB2' ' A' ' 33' ' ' CYS . . . 71.62 19.98 78.22 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.336 -0.459 . . . . 0.0 113.257 175.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.468 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 2.2 mmp_? -77.62 179.14 6.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.716 0.258 . . . . 0.0 110.538 178.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -103.85 151.56 22.95 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.078 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -69.17 89.7 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 110.415 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.736 HG22 ' HB3' ' A' ' 18' ' ' PRO . 1.5 t -101.3 179.46 4.35 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.151 178.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.3 m 75.32 -47.97 0.61 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.396 0.679 . . . . 0.0 110.986 -177.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -134.52 75.79 0.41 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.07 -0.586 . . . . 0.0 111.777 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.71 95.3 0.92 Allowed 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.133 2.555 . . . . 0.0 112.477 -177.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.754 176.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.741 0 N-CA-C 111.806 -0.517 . . . . 0.0 111.806 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.53 50.28 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.326 0.584 . . . . 0.0 110.421 179.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 9.3 tpt -86.96 78.05 9.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.548 -177.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.39 85.27 2.52 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 173.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.08 118.8 15.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.146 -175.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.581 ' HE3' ' HB2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -84.74 99.82 11.11 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 170.74 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -76.23 10.99 1.68 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.007 -173.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.581 ' HB2' ' HE3' ' A' ' 6' ' ' LYS . 1.7 t80 -74.68 92.85 2.49 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 174.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.7 103.12 2.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.201 -177.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -94.77 170.27 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.442 177.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.35 168.67 12.08 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.244 -179.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -67.63 -45.17 76.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.456 -175.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -80.11 -15.33 79.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.59 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -70.8 143.33 51.19 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.443 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 12.5 p-90 -130.24 165.34 22.62 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.764 -171.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.1 pp -110.17 156.67 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 22' ' ' CYS . 23.1 m -46.17 146.8 2.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 O-C-N 123.951 0.782 . . . . 0.0 112.999 -176.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 16.5 Cg_exo -69.13 -18.43 39.96 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.987 2.458 . . . . 0.0 113.312 -173.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -123.85 171.46 9.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.124 0.488 . . . . 0.0 111.641 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.91 -24.92 22.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.296 177.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -78.63 -12.0 60.0 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.251 173.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 1.027 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -87.45 -83.6 0.2 Allowed 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.546 174.072 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.99 36.41 90.2 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.766 171.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.823 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 6.4 t30 -104.78 159.28 15.91 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 117.333 0.566 . . . . 0.0 110.317 175.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.46 117.48 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 175.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.442 HD22 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -114.87 173.93 6.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.321 0.581 . . . . 0.0 111.456 -171.91 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -101.24 139.11 37.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.25 -179.834 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.25 -37.66 24.1 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.85 174.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.2 mtt-85 -84.09 18.22 2.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.919 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 27' ' ' PHE . 0.8 OUTLIER -121.36 114.64 21.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.776 178.775 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.15 -9.58 59.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.089 0.471 . . . . 0.0 110.955 177.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.3 OUTLIER -136.45 153.67 50.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 176.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.442 ' HA ' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -60.53 174.65 0.54 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.144 0.973 . . . . 0.0 113.53 -179.71 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -100.16 -26.12 14.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 113.745 -1.571 . . . . 0.0 110.049 177.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -103.33 -65.41 1.01 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.528 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -40.64 38.21 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.981 0.42 . . . . 0.0 111.75 -175.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.437 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 86.28 49.02 4.35 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.365 176.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.598 ' O ' ' HA ' ' A' ' 32' ' ' SER . 0.9 OUTLIER -105.68 153.83 21.29 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 175.288 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.32 140.7 29.83 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.44 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 44.7 tttm -67.39 100.78 0.87 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.721 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.45 108.88 13.32 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.358 -178.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -71.82 -33.35 68.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.362 0.601 . . . . 0.0 109.483 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.434 ' HA2' ' HD3' ' A' ' 44' ' ' PRO . . . -160.0 147.89 15.61 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.909 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.507 ' HB2' ' H ' ' A' ' 45' ' ' ILE . 19.6 Cg_exo -66.33 -97.31 0.0 OUTLIER 'Trans proline' 0 CA--C 1.528 0.22 0 C-N-CA 122.694 2.263 . . . . 0.0 111.956 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.507 ' H ' ' HB2' ' A' ' 44' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.499 -0.763 . . . . 0.0 110.117 177.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.889 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.7 m 69.55 -67.58 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.435 0.694 . . . . 0.0 111.455 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 20.3 tpp -112.54 112.38 23.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.757 0.313 . . . . 0.0 110.298 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.31 134.6 40.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.695 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.42 ' O ' ' HD2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -72.41 98.78 2.31 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.252 176.377 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -77.09 -39.27 50.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.183 0.516 . . . . 0.0 110.061 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -99.94 122.09 42.32 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 175.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.1 t80 61.35 80.2 0.23 Allowed 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 123.806 0.691 . . . . 0.0 109.594 -172.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' HD2' ' O ' ' A' ' 5' ' ' THR . 4.3 mmm-85 -75.46 81.02 2.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.163 -174.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -83.52 82.89 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.405 176.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.62 34.76 2.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.054 172.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -100.44 -145.08 0.34 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.289 -172.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.69 19.58 36.3 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.45 ' HA ' ' HA ' ' A' ' 28' ' ' ALA . 3.3 p30 -73.37 176.22 6.21 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.158 -0.521 . . . . 0.0 110.465 178.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.511 ' HZ3' ' HD3' ' A' ' 18' ' ' PRO . 32.7 p-90 -160.98 150.94 17.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 24' ' ' ASN . 1.0 OUTLIER -102.3 157.53 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -43.15 140.54 2.02 Favored Pre-proline 0 C--O 1.236 0.353 0 O-C-N 123.886 0.741 . . . . 0.0 111.189 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.511 ' HD3' ' HZ3' ' A' ' 15' ' ' TRP . 50.4 Cg_exo -56.26 -31.43 84.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.813 2.342 . . . . 0.0 112.661 -172.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.58 121.25 42.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 173.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 pttp -81.97 35.91 0.44 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -169.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -84.44 -14.16 50.07 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 165.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 t -108.12 -74.96 0.64 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 113.941 -1.481 . . . . 0.0 108.016 171.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.07 29.36 62.78 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.818 177.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 17.7 t30 -64.43 128.41 35.69 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 178.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.43 HG22 ' H ' ' A' ' 25' ' ' VAL . 0.0 OUTLIER -79.19 99.02 3.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.193 0.52 . . . . 0.0 109.748 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -84.26 147.11 27.42 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.5 -176.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -37.02 -73.46 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 O-C-N 124.57 1.169 . . . . 0.0 112.568 -175.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . 178.47 -59.32 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.414 0.626 . . . . 0.0 109.71 178.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 29' ' ' ARG . 1.2 mmt180 -91.28 11.35 23.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.528 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.583 ' HD3' ' O ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -68.09 115.34 7.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.111 174.187 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.59 -21.64 35.11 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.832 0.349 . . . . 0.0 110.868 -177.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.583 ' O ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -127.05 148.7 50.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.214 178.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.711 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 52.2 t -57.1 138.16 54.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.092 0.472 . . . . 0.0 110.913 178.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.15 -20.98 60.04 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.078 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 35' ' ' ARG . 1.9 mtm-85 -91.92 -55.22 3.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.279 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.5 m -85.65 -59.61 2.26 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.716 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.711 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.19 -3.19 28.31 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -65.26 140.82 58.75 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 176.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -80.63 148.36 30.29 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.617 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -55.03 99.99 0.03 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.223 0.535 . . . . 0.0 110.966 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 2.06 50.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.589 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.0 113.82 24.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.315 -178.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 96.59 111.27 2.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.469 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -86.38 175.28 5.56 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 123.005 2.47 . . . . 0.0 112.635 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.744 -0.646 . . . . 0.0 110.359 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_