data_1v91_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 1v91 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.864 0.364 . . . . 1.0 110.871 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.5 m -84.26 142.83 12.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.181 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.13 -160.36 1.63 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 1.0 112.581 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.63 128.22 36.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.881 0.372 . . . . 1.0 110.961 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 86.89 -7.87 78.38 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.922 -0.656 . . . . 1.0 112.84 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.52 126.4 29.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.618 0.247 . . . . 1.0 110.907 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.583 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 43.2 mtt85 -70.32 144.62 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 1.0 111.11 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -72.88 136.69 45.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.909 -0.587 . . . . 1.0 110.529 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -38.16 149.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.293 -0.412 . . . . 1.0 111.772 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.1 t 37.17 -91.31 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.01 -0.541 . . . . 1.0 112.163 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.76 -29.62 1.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.626 0.25 . . . . 1.0 111.156 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.8 p -179.52 71.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.782 0.325 . . . . 1.0 110.747 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.57 -84.57 1.8 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.761 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 39.7 Cg_endo -67.37 168.73 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.442 2.095 . . . . 1.0 112.479 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -101.37 -173.35 2.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.957 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 166.17 11.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.809 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.415 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 73.4 m -53.39 -176.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.055 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -80.04 85.61 5.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.16 -25.63 3.16 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.663 -0.78 . . . . 1.0 112.713 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.496 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -85.57 170.21 12.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.903 0.382 . . . . 1.0 110.986 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.441 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 17.1 m-85 -137.82 176.85 8.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 1.0 110.358 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.1 t -126.66 108.21 10.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 1.0 111.009 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.99 166.43 15.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.366 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.17 64.37 0.96 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.939 0.4 . . . . 1.0 111.253 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' MET . 0.7 OUTLIER -61.49 -162.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.403 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.14 75.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.439 -0.346 . . . . 1.0 110.925 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 178.72 149.62 0.42 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.625 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.34 -45.71 0.79 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.52 2.147 . . . . 1.0 112.415 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.583 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER -71.03 95.4 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.803 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.7 m -62.85 155.22 27.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.683 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.52 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -111.15 142.59 43.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.307 . . . . 1.0 110.962 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -119.84 123.73 44.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.203 179.484 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.96 174.19 15.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.156 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.496 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.1 t30 -45.95 168.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.425 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.441 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.68 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.112 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.242 -0.885 . . . . 1.0 110.886 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.1 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.847 0.356 . . . . 1.0 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.5 m -86.89 154.27 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 1.0 111.258 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.51 -160.39 31.6 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.799 -0.715 . . . . 1.0 112.562 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.06 133.69 34.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 1.0 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.19 -1.11 81.96 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.89 -0.671 . . . . 1.0 112.813 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.39 124.57 24.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.73 0.3 . . . . 1.0 111.218 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.08 115.36 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 1.0 110.688 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.26 144.66 15.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.887 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.432 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -47.09 137.93 7.26 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.317 -0.401 . . . . 1.0 111.355 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.4 t 36.74 -90.83 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.988 -0.551 . . . . 1.0 112.177 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.432 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -123.3 -29.14 3.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.672 0.272 . . . . 1.0 111.172 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.23 71.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.876 0.369 . . . . 1.0 110.874 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.28 -88.49 1.41 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.774 -0.727 . . . . 1.0 112.589 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.57 168.43 24.44 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.424 2.083 . . . . 1.0 112.377 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -97.37 175.5 6.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.78 165.35 12.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.852 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.7 m -53.63 -176.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.99 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.76 84.17 4.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.703 -0.681 . . . . 1.0 110.954 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.26 -28.16 2.71 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.667 -0.778 . . . . 1.0 112.597 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 6.0 m-30 -83.77 174.04 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 1.0 110.939 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.457 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 26.2 m-85 -142.84 179.94 6.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 1.0 110.484 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -131.4 119.41 21.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.837 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.08 164.81 11.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.039 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.4 m -132.39 60.94 1.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -56.19 -170.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.043 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -64.27 78.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.125 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.01 141.59 0.29 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.798 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.8 58.85 6.16 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.532 2.155 . . . . 1.0 112.415 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -178.85 89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.888 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.0 m -55.26 132.69 48.41 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.935 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.66 154.96 18.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.096 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.74 126.61 52.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.304 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -153.88 172.42 17.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.481 -0.327 . . . . 1.0 111.039 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.458 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 37.1 t30 -46.41 169.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.458 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.457 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 1.0 111.007 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.871 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.9 m -90.41 144.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.077 -0.51 . . . . 1.0 111.274 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.24 -160.17 2.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.854 -0.689 . . . . 1.0 112.811 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.97 128.83 35.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.837 0.351 . . . . 1.0 111.009 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 79.62 -1.57 77.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.84 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -70.55 136.11 49.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 1.0 111.238 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 22.1 mmt-85 -70.41 130.7 42.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.308 -0.405 . . . . 1.0 110.647 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.8 m -64.72 146.31 54.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.233 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.41 ' CB ' ' CD ' ' A' ' 15' ' ' PRO . . . -44.94 144.9 1.07 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.611 -0.268 . . . . 1.0 111.288 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t 37.75 -92.09 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.138 -0.483 . . . . 1.0 112.018 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.409 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.83 -28.46 2.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.613 0.244 . . . . 1.0 111.141 179.735 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p 175.48 73.24 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 1.0 110.769 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.82 -82.32 1.6 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.777 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.97 168.66 23.31 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.457 2.105 . . . . 1.0 112.421 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -96.73 -172.38 2.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.82 166.87 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.412 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 72.6 m -52.58 -176.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.112 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.9 84.2 2.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.78 -26.92 3.56 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.648 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -84.96 170.45 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.821 0.343 . . . . 1.0 110.854 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 14.8 m-85 -140.19 174.52 10.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.484 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 30.6 t -115.2 118.02 32.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.691 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.5 m -101.04 166.04 11.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.688 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.41 59.52 1.02 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.925 0.393 . . . . 1.0 111.107 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 28' ' ' MET . 2.8 ttm180 -59.35 -163.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.64 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -61.32 81.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 1.0 110.919 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 179.21 148.62 0.43 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.682 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -74.55 -22.35 15.97 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.576 2.184 . . . . 1.0 112.529 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.424 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -94.93 104.45 16.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.125 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.6 m -64.76 143.85 57.65 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.391 -0.368 . . . . 1.0 110.116 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -110.76 168.91 9.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.086 0.469 . . . . 1.0 111.682 -179.239 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -140.1 125.59 19.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.615 -0.721 . . . . 1.0 110.175 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -153.63 174.2 14.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.908 0.385 . . . . 1.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.514 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.6 t30 -46.14 169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.518 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.3 p30 -69.59 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 1.0 111.103 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.256 -0.878 . . . . 1.0 110.875 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.86 0.362 . . . . 1.0 110.9 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.4 m -92.66 142.94 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.506 . . . . 1.0 111.152 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.53 -160.25 7.31 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.787 -0.721 . . . . 1.0 112.782 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.05 137.12 33.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.815 0.34 . . . . 1.0 110.931 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 76.46 3.23 77.21 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.852 -0.689 . . . . 1.0 112.859 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.38 122.73 20.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.71 0.29 . . . . 1.0 111.109 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.579 ' HG2' ' CG ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -69.95 107.82 3.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.58 179.62 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.9 m -48.14 134.77 13.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.781 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.4 147.93 0.52 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.375 -0.375 . . . . 1.0 111.361 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.99 -89.56 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.02 -0.536 . . . . 1.0 112.055 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.464 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.04 -31.87 3.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.623 0.249 . . . . 1.0 111.088 179.724 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -178.25 70.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.909 0.385 . . . . 1.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.59 -89.86 1.76 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.883 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.424 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 52.6 Cg_exo -54.43 156.4 14.13 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.461 2.107 . . . . 1.0 112.54 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -101.75 146.37 27.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.656 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 161.63 27.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 1.0 111.005 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.53 -176.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.098 0.475 . . . . 1.0 110.992 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.73 85.27 2.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.861 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.56 -28.13 2.9 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.533 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.48 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.6 m-30 -85.41 173.79 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.862 0.363 . . . . 1.0 110.956 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.454 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 28.7 m-85 -145.08 179.11 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.995 -0.548 . . . . 1.0 110.376 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.7 t -120.46 116.33 25.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.582 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.91 162.94 13.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.053 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 39.2 m -150.02 69.9 1.03 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.735 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 ttm-85 -71.21 63.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.044 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m 48.97 81.6 0.05 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.254 -0.43 . . . . 1.0 111.256 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -156.48 169.54 10.35 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.905 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -92.05 25.52 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.123 2.548 . . . . 1.0 112.458 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.579 ' CG ' ' HG2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -174.55 93.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.588 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.4 m -56.02 153.04 9.41 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.005 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -115.77 161.4 18.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.975 0.417 . . . . 1.0 111.216 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 126.43 44.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.0 110.428 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.2 173.4 15.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.94 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.48 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 47.1 t30 -45.85 168.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 1.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.454 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.2 p30 -69.7 -76.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.004 -0.544 . . . . 1.0 111.058 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.4 t . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.236 -0.888 . . . . 1.0 110.907 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.6 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.858 0.361 . . . . 1.0 110.962 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.6 m -84.74 148.46 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 1.0 111.217 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.59 -160.22 4.13 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.802 -0.714 . . . . 1.0 112.623 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.6 136.33 33.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.862 0.363 . . . . 1.0 110.931 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 74.47 5.59 73.37 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.907 -0.663 . . . . 1.0 112.83 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.5 120.68 16.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.702 0.287 . . . . 1.0 111.089 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.423 ' HG3' ' CD1' ' A' ' 30' ' ' TYR . 3.4 ptp180 -70.27 120.82 16.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.362 . . . . 1.0 110.642 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.8 m -56.17 142.4 37.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.857 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -48.92 147.48 2.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.339 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 33.93 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.995 -0.548 . . . . 1.0 112.166 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -30.32 2.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.734 0.302 . . . . 1.0 111.136 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -178.58 70.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.881 0.372 . . . . 1.0 110.756 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.76 -85.66 1.72 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.718 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.63 168.21 23.33 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.449 2.099 . . . . 1.0 112.39 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -99.32 -176.65 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.954 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 165.47 12.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.7 m -53.89 -175.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.038 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.26 88.52 7.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.988 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.21 -25.0 3.2 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.67 -0.776 . . . . 1.0 112.806 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -87.48 170.08 11.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.872 0.368 . . . . 1.0 111.055 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.436 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.7 m-85 -137.67 174.33 10.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.397 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 40.9 t -127.41 109.81 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 1.0 110.999 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -96.57 159.5 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.776 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.1 m -129.87 59.42 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 1.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.1 -169.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.079 -0.509 . . . . 1.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -63.23 82.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 1.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.52 144.83 0.41 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.843 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.6 54.93 5.42 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.631 2.221 . . . . 1.0 112.476 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.423 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER 176.55 97.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 1.0 110.782 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.3 m -54.94 140.61 36.68 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.336 -0.393 . . . . 1.0 110.96 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.413 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.43 142.68 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.983 -179.687 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -110.85 124.4 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 1.0 110.477 179.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -149.19 171.52 16.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.028 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.492 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.7 t30 -51.26 170.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.206 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.436 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.63 -77.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 1.0 111.066 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 1.0 110.872 179.992 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.887 0.375 . . . . 1.0 110.917 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.4 m -91.85 143.42 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 1.0 111.386 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.19 -160.32 0.82 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.766 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 21' ' ' TYR . 1.2 m-20 -88.33 128.62 35.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.876 0.369 . . . . 1.0 111.076 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 84.89 -7.59 73.79 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.92 -0.657 . . . . 1.0 112.892 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -70.87 131.0 43.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.636 0.255 . . . . 1.0 111.145 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.814 ' CD ' ' CG ' ' A' ' 30' ' ' TYR . 45.3 mtm-85 -70.11 143.42 52.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.73 0.3 . . . . 1.0 110.582 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.7 m -73.54 151.61 40.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.414 -0.357 . . . . 1.0 110.231 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.443 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -45.17 148.05 0.65 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.578 -0.283 . . . . 1.0 111.385 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 36.26 -89.57 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.081 -0.508 . . . . 1.0 112.061 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.443 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.9 -35.17 2.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.74 0.305 . . . . 1.0 110.873 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p 179.63 70.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 1.0 110.722 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -96.57 -82.35 1.62 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.814 -0.708 . . . . 1.0 112.669 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.405 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 56.2 Cg_endo -70.5 166.1 29.63 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.439 2.093 . . . . 1.0 112.349 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.69 -174.48 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.9 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 166.88 10.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.84 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 97.0 m -52.6 -176.66 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 1.0 111.127 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.58 83.31 2.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.581 -0.736 . . . . 1.0 110.882 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 134.66 -25.47 3.41 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.495 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -87.32 170.57 11.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.844 0.354 . . . . 1.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.456 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.7 m-85 -138.64 177.68 7.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.615 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 12.9 t -124.43 111.02 15.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.98 -0.555 . . . . 1.0 110.881 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.0 172.04 7.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.704 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 m -147.27 68.55 1.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.344 -0.389 . . . . 1.0 110.773 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -58.15 -171.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.075 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -64.85 78.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER 175.31 128.52 0.13 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.687 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.39 73.65 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 1.0 112.349 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.814 ' CG ' ' CD ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 175.88 92.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.795 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.8 m -60.53 132.11 52.88 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.551 -0.295 . . . . 1.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -101.53 153.24 19.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.76 0.314 . . . . 1.0 111.138 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -122.3 123.61 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.308 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.77 174.42 15.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.332 -0.395 . . . . 1.0 111.185 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.495 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.0 t30 -44.55 167.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.656 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.65 -77.34 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.015 -0.539 . . . . 1.0 111.11 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.18 -0.914 . . . . 1.0 110.94 -179.95 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.2 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.882 0.372 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.7 m -115.94 143.41 25.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.905 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.54 -158.79 30.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.441 -0.885 . . . . 1.0 112.895 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 55.26 58.84 4.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.387 . . . . 1.0 111.156 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.65 3.71 73.5 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.928 -0.654 . . . . 1.0 112.977 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.52 131.05 43.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 1.0 111.213 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.39 124.28 23.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.689 179.509 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -60.19 137.95 58.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.563 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -47.46 146.71 1.96 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.404 . . . . 1.0 111.302 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t 34.78 -88.95 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.089 -0.505 . . . . 1.0 112.048 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.47 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.92 -36.08 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.745 0.307 . . . . 1.0 110.931 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 p -179.31 71.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 1.0 110.72 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -101.02 -85.69 1.88 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.858 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.07 165.54 6.78 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.365 2.044 . . . . 1.0 112.392 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -100.12 146.85 26.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.651 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.8 158.95 30.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.893 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.9 m -54.14 -176.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.077 0.465 . . . . 1.0 110.961 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -85.45 107.21 17.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.027 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.51 -26.31 7.36 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.739 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.506 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.65 170.18 9.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 1.0 110.938 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.449 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.2 m-85 -136.76 178.79 6.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.684 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -123.31 118.69 28.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.825 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.06 129.32 46.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.846 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.9 m -106.34 47.48 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 1.0 110.821 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -57.91 -166.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.942 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -62.72 81.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 1.0 111.014 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.2 126.38 0.25 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 1.0 110.734 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.95 -27.31 44.2 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.416 2.077 . . . . 1.0 112.281 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.02 95.42 5.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.951 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.5 m -55.74 149.32 14.65 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.836 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 16.6 mtt85 -107.03 160.78 15.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.953 0.406 . . . . 1.0 111.136 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -131.6 127.78 37.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.196 179.646 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.29 174.47 14.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.741 0.305 . . . . 1.0 111.127 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.506 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.3 t-20 -43.07 165.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.449 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.57 -76.41 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.971 -0.559 . . . . 1.0 111.109 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.254 -0.879 . . . . 1.0 110.906 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.894 0.378 . . . . 1.0 110.885 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.11 148.63 4.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.296 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.73 -160.21 19.8 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.807 -0.711 . . . . 1.0 112.645 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -81.6 138.44 35.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.364 . . . . 1.0 111.031 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.42 9.93 59.09 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.956 -0.64 . . . . 1.0 112.814 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.47 127.64 33.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.682 0.277 . . . . 1.0 111.306 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.16 111.37 5.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.387 -0.37 . . . . 1.0 110.516 179.372 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 24.6 m -52.75 138.95 27.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.854 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.78 147.15 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.466 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 33.84 -89.2 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.121 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.46 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.83 -34.73 1.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.677 0.275 . . . . 1.0 110.96 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 p -177.7 70.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.404 . . . . 1.0 110.844 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.01 -81.3 1.58 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.751 -0.738 . . . . 1.0 112.749 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.401 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 51.5 Cg_endo -69.41 168.19 21.81 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.447 2.098 . . . . 1.0 112.46 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -97.4 -168.3 1.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.75 166.38 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.982 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 88.9 m -53.16 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.046 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -81.96 83.85 7.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.71 -0.677 . . . . 1.0 110.866 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.76 -26.61 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.613 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.05 170.16 10.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 1.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.455 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.5 m-85 -138.57 173.82 11.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.402 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.79 113.83 26.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.291 -0.413 . . . . 1.0 110.772 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.1 164.46 12.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.694 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.4 m -150.9 65.73 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.034 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -66.72 -163.95 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.66 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -63.44 80.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 1.0 110.911 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.37 155.04 5.98 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.824 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.55 -37.2 3.27 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.206 . . . . 1.0 112.415 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.17 122.82 40.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.047 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 36.7 m -72.01 162.65 29.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.391 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.77 172.47 11.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.087 0.47 . . . . 1.0 111.517 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.414 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -135.3 128.43 31.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.297 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -147.74 171.18 16.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.767 0.318 . . . . 1.0 111.065 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.502 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.6 t30 -50.5 170.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 1.0 111.257 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.455 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.65 -76.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.062 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.2 -0.905 . . . . 1.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.841 0.353 . . . . 1.0 110.9 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -91.94 144.14 9.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.084 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.71 -160.32 13.45 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.766 -0.731 . . . . 1.0 112.663 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.93 138.8 33.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.79 0.328 . . . . 1.0 110.963 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.68 3.07 71.73 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.863 -0.684 . . . . 1.0 112.933 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.35 120.12 15.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.725 0.297 . . . . 1.0 111.112 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HG2' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.1 106.57 3.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.599 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 96.3 m -48.06 133.96 14.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.314 -0.403 . . . . 1.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -42.84 144.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.87 -90.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.931 -0.577 . . . . 1.0 112.117 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.58 -25.85 3.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.633 0.254 . . . . 1.0 111.238 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 p 178.92 71.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.856 0.36 . . . . 1.0 110.905 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.01 -95.72 1.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.631 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.18 164.3 1.88 Allowed 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.311 2.008 . . . . 1.0 112.444 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -107.08 149.41 27.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 160.27 33.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.86 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.74 -176.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.978 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -77.02 84.25 3.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.911 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 139.27 -27.07 2.66 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.754 -0.736 . . . . 1.0 112.607 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.468 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.2 m-30 -88.07 173.3 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.847 0.356 . . . . 1.0 110.943 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 24.5 m-85 -141.68 179.2 6.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.419 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.0 t -125.83 114.17 18.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.811 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.89 154.01 17.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 1.0 110.948 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.15 57.53 1.39 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.874 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -175.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.9 82.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.958 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.78 145.15 0.46 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.812 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -79.69 54.74 5.33 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.691 2.261 . . . . 1.0 112.46 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.447 ' CD1' ' HG2' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.85 89.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.777 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.8 m -55.03 144.41 23.59 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.918 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.24 158.01 19.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.953 0.406 . . . . 1.0 111.031 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.93 127.64 54.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.604 179.842 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -152.54 171.66 17.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.855 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.468 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 29.6 t30 -47.09 170.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 1.0 111.361 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.6 -76.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.088 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.249 -0.882 . . . . 1.0 110.885 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.918 0.389 . . . . 1.0 110.946 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -132.77 143.44 39.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.971 -0.558 . . . . 1.0 110.935 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.437 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 178.34 -158.06 22.46 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.438 -0.887 . . . . 1.0 113.001 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 56.55 66.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.909 0.385 . . . . 1.0 111.147 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.27 -2.73 80.63 Favored Glycine 0 CA--C 1.52 0.347 0 C-N-CA 120.948 -0.644 . . . . 1.0 112.912 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.57 119.09 14.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.724 0.262 . . . . 1.0 111.182 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 2.7 ptp180 -70.26 119.19 14.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.946 0.403 . . . . 1.0 110.623 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.69 140.41 23.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.035 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.59 147.89 1.12 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.254 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.939 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.457 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.32 -24.41 3.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.635 0.255 . . . . 1.0 111.1 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 p 175.02 73.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.824 0.345 . . . . 1.0 110.708 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.73 -94.12 2.02 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.753 -0.737 . . . . 1.0 112.902 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -55.98 161.21 8.86 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.357 2.038 . . . . 1.0 112.466 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -96.19 152.58 18.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.678 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.14 156.85 28.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 1.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 74.4 m -53.76 -176.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.105 0.479 . . . . 1.0 110.959 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.16 93.96 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.782 -0.645 . . . . 1.0 111.036 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.45 3.52 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.656 -0.783 . . . . 1.0 112.778 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.15 170.1 9.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 1.0 111.05 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.451 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.3 m-85 -137.3 179.12 6.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.372 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 t -126.24 113.76 17.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.455 . . . . 1.0 111.004 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.45 139.43 32.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.529 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.5 m -116.19 52.38 0.92 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.962 0.411 . . . . 1.0 111.006 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.8 ttm180 -58.46 -163.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.769 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.57 81.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.487 -0.324 . . . . 1.0 110.978 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 178.96 147.8 0.4 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.726 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.79 -34.67 6.56 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.548 2.165 . . . . 1.0 112.252 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.449 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -97.01 96.45 8.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.835 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.4 m -55.45 151.55 10.06 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.492 -0.322 . . . . 1.0 110.731 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -108.58 142.39 39.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.884 0.373 . . . . 1.0 111.115 -179.546 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.437 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -114.22 124.02 51.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.122 179.453 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.31 174.05 15.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.157 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.503 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.8 t30 -43.2 165.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.462 . . . . 1.0 111.675 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.451 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.56 -77.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.091 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.231 -0.89 . . . . 1.0 110.911 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.6 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.947 0.403 . . . . 1.0 110.946 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.88 149.16 26.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.894 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.427 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 167.59 -158.4 31.24 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.37 -0.919 . . . . 1.0 112.905 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 56.13 58.74 4.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.385 . . . . 1.0 111.216 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.23 -0.52 83.85 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.824 -0.703 . . . . 1.0 113.011 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.26 129.32 39.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.778 0.323 . . . . 1.0 111.264 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.49 122.9 20.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 1.0 110.585 179.541 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 7.5 m -55.54 141.22 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.496 -0.32 . . . . 1.0 110.614 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -49.24 145.16 4.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.363 -0.38 . . . . 1.0 111.216 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.85 -89.0 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.042 -0.526 . . . . 1.0 112.053 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.471 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -35.83 2.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.731 0.301 . . . . 1.0 111.01 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.7 p -179.57 71.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.889 0.376 . . . . 1.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.29 -87.48 1.93 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.739 -0.744 . . . . 1.0 112.735 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.77 168.26 5.82 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.401 2.068 . . . . 1.0 112.36 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -105.12 147.11 28.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.634 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.64 158.06 36.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.863 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.7 m -53.84 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.107 0.48 . . . . 1.0 111.079 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -82.6 105.06 13.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.974 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.08 -25.94 6.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.652 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.02 170.53 9.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.788 0.328 . . . . 1.0 110.959 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -136.48 179.85 6.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.696 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.5 t -126.31 114.83 18.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -99.02 168.84 9.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.428 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.3 m -148.71 66.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.912 0.387 . . . . 1.0 111.189 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -162.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.55 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.8 m -67.21 66.95 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 5.2 mmt -159.98 135.46 5.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.729 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.17 -29.52 75.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.398 2.065 . . . . 1.0 112.432 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.21 119.72 36.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 1.0 111.126 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.3 m -71.84 151.01 43.77 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.291 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -110.44 154.91 22.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.858 0.361 . . . . 1.0 111.267 -179.282 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.427 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -131.1 127.54 38.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.068 -0.514 . . . . 1.0 110.1 179.406 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -162.29 173.78 13.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.747 0.308 . . . . 1.0 111.154 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.503 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 40.8 t30 -43.16 165.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.709 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.447 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.58 -76.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.096 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 1.0 110.926 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.85 0.357 . . . . 1.0 110.943 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m -81.98 147.29 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.15 -160.11 7.98 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.85 -0.69 . . . . 1.0 112.623 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.98 138.76 33.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.863 0.363 . . . . 1.0 110.995 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.92 12.75 58.07 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.864 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.4 127.77 33.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 1.0 111.09 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.2 111.22 5.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.623 179.554 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' CE1' ' A' ' 30' ' ' TYR . 70.5 m -52.87 134.44 37.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.744 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -43.68 143.88 0.92 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.575 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.17 -90.13 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.945 -0.57 . . . . 1.0 112.151 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.445 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.39 -30.46 1.91 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.663 0.268 . . . . 1.0 111.262 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -178.71 70.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.819 0.342 . . . . 1.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.65 -84.0 1.75 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.755 -0.736 . . . . 1.0 112.743 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 57.6 Cg_endo -71.61 168.56 23.3 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.472 2.115 . . . . 1.0 112.443 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -97.51 -170.8 2.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.964 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.55 165.75 12.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.6 m -53.51 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 1.0 111.059 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.84 84.22 7.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.877 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.01 -26.6 2.6 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.703 -0.761 . . . . 1.0 112.594 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.7 m-30 -90.38 169.82 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.34 . . . . 1.0 110.939 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.2 m-85 -137.2 174.17 10.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.432 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 51.8 t -113.29 113.21 24.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.312 -0.403 . . . . 1.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 t -94.16 167.47 11.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 1.0 110.665 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 62.8 m -150.62 63.86 0.94 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.956 0.408 . . . . 1.0 111.085 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -63.31 -163.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.604 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.17 81.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 1.0 110.871 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.28 149.69 0.68 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.848 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.95 -36.68 7.29 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 1.0 112.371 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.452 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER -90.19 112.21 23.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.932 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.01 162.16 22.7 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.555 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.418 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -126.29 170.22 12.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.009 0.433 . . . . 1.0 111.387 -179.634 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.06 129.53 34.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.796 -0.638 . . . . 1.0 110.409 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -151.13 169.97 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 1.0 110.976 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.499 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.9 t30 -49.09 170.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 1.0 111.276 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.67 -76.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.999 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.4 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.174 -0.917 . . . . 1.0 110.877 -179.98 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.423 ' HB2' ' N ' ' A' ' 18' ' ' CYS . 27.9 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.945 0.402 . . . . 1.0 110.983 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -93.25 164.76 2.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.096 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.71 -160.71 32.45 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.859 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -88.19 132.48 34.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.891 0.377 . . . . 1.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.39 6.96 59.59 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.961 -0.637 . . . . 1.0 112.826 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.97 129.48 39.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.584 0.231 . . . . 1.0 111.23 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.499 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.37 112.22 6.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.969 0.414 . . . . 1.0 110.562 179.507 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.2 m -50.51 139.84 15.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.312 -0.404 . . . . 1.0 110.856 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.31 145.84 0.76 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.404 -0.362 . . . . 1.0 111.314 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 35.49 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.729 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.462 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -142.48 5.03 1.6 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.473 0.175 . . . . 1.0 111.473 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 12' ' ' TRP . 1.7 p 163.31 77.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.717 0.294 . . . . 1.0 110.558 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.66 -100.06 2.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.602 -0.809 . . . . 1.0 113.063 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 50.5 Cg_exo -53.15 165.95 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.426 2.084 . . . . 1.0 112.705 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -108.94 149.39 29.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 1.0 110.618 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.09 157.35 38.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 1.0 111.026 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.423 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 76.1 m -62.45 -176.62 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.914 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.43 94.04 2.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.98 -9.24 7.12 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.739 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 2.0 m-85 -110.62 170.75 7.89 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.749 0.309 . . . . 1.0 110.775 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.453 ' CD2' ' HA ' ' A' ' 36' ' ' ASN . 18.5 m-85 -142.44 173.64 11.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.266 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.4 t -117.35 114.43 23.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.25 -0.432 . . . . 1.0 111.188 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -95.77 169.47 9.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.37 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 85.3 m -151.32 70.29 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 1.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -62.12 -164.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.635 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -69.5 65.06 0.18 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.903 0.382 . . . . 1.0 111.159 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 9.1 mmt -155.83 157.12 31.3 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.788 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.48 -45.52 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.514 2.142 . . . . 1.0 112.378 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.54 107.57 16.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 1.0 110.857 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.6 m -61.21 167.6 3.03 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.253 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.499 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -128.21 164.25 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.085 0.469 . . . . 1.0 111.795 -179.413 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.443 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.21 124.96 23.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.189 179.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -145.21 172.68 12.78 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.831 0.348 . . . . 1.0 111.096 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.449 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 19.3 t30 -50.97 171.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.923 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.453 ' HA ' ' CD2' ' A' ' 22' ' ' TYR . 1.4 p30 -69.9 -77.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.985 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.194 -0.908 . . . . 1.0 110.887 -179.938 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.9 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.886 0.374 . . . . 1.0 110.93 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.3 m -92.63 145.27 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 1.0 111.129 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.05 -160.95 8.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.811 -0.709 . . . . 1.0 112.715 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.71 135.0 33.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 1.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.01 0.87 77.6 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 1.0 112.772 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.45 128.39 36.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.726 0.298 . . . . 1.0 111.229 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.32 115.5 9.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 1.0 110.556 179.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 64.1 m -55.77 135.65 51.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.436 -0.347 . . . . 1.0 110.561 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.55 146.44 0.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.543 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.38 -90.03 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.042 -0.527 . . . . 1.0 111.986 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.65 -23.75 3.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.599 0.238 . . . . 1.0 111.305 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p 177.36 72.54 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.885 0.374 . . . . 1.0 110.764 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.19 -94.24 2.06 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.822 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 51.3 Cg_exo -53.48 165.1 1.73 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.353 2.035 . . . . 1.0 112.574 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -108.49 149.44 28.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.653 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 157.22 38.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -57.28 -176.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.088 0.47 . . . . 1.0 110.957 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -75.68 87.47 2.74 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 135.75 -27.31 3.08 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.33 170.45 9.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.723 0.297 . . . . 1.0 110.783 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.472 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.1 m-85 -139.71 173.59 11.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.572 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.2 t -111.43 112.99 25.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.687 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.94 166.03 12.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.695 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.5 m -151.22 66.42 0.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.985 0.422 . . . . 1.0 110.993 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -68.17 -163.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.663 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -63.83 79.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.1 141.07 0.42 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.778 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.02 -62.68 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.469 2.112 . . . . 1.0 112.294 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.88 115.02 6.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.999 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.1 m -69.6 169.32 12.93 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.326 -0.397 . . . . 1.0 110.329 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.1 170.02 14.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.07 0.462 . . . . 1.0 111.467 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.419 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -139.43 126.89 21.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.394 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.27 173.34 15.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 1.0 111.054 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.514 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 33.3 t30 -47.51 170.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.406 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.472 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.2 p30 -69.54 -76.43 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 1.0 111.042 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.925 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.792 0.33 . . . . 1.0 110.904 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 m -111.83 162.96 9.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.058 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.16 -160.32 31.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.645 -0.788 . . . . 1.0 112.595 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 53.13 63.75 2.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.883 0.373 . . . . 1.0 111.074 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.39 2.02 83.08 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.901 -0.666 . . . . 1.0 112.871 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -70.34 123.2 21.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.736 0.303 . . . . 1.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.18 122.78 20.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.814 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 79.8 m -59.62 142.11 53.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.521 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.18 140.6 3.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.371 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.21 -90.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.005 -0.543 . . . . 1.0 112.098 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.81 -29.74 2.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.697 0.284 . . . . 1.0 111.129 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p 178.23 72.14 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 1.0 110.771 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.45 -91.58 1.57 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.701 -0.762 . . . . 1.0 112.74 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.19 168.53 24.5 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.471 2.114 . . . . 1.0 112.466 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -81.62 -170.49 2.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.38 165.79 20.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.505 . . . . 1.0 110.796 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.8 m -53.68 -176.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.99 -0.55 . . . . 1.0 111.045 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -93.59 124.75 37.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.749 -0.659 . . . . 1.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.85 -27.69 14.11 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.709 -0.757 . . . . 1.0 112.623 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.498 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.67 170.32 9.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.838 0.351 . . . . 1.0 110.933 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.442 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 16.3 m-85 -135.82 177.19 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.053 -0.522 . . . . 1.0 110.411 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.7 t -127.67 110.69 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.973 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -99.2 170.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.68 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.6 m -142.17 65.75 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -60.08 -168.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.91 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 m -64.99 78.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.034 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.406 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER 179.71 129.74 0.24 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.725 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 18.9 Cg_exo -66.26 63.76 0.49 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.527 2.152 . . . . 1.0 112.307 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 177.13 94.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.861 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -56.97 136.36 56.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.782 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.97 142.64 34.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.94 0.4 . . . . 1.0 111.095 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -109.11 124.97 51.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.422 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -153.04 170.83 19.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.446 -0.343 . . . . 1.0 111.014 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.498 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.3 t30 -46.39 168.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.332 -0.394 . . . . 1.0 111.454 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.442 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.72 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 1.0 111.077 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.272 -0.87 . . . . 1.0 110.896 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.897 0.379 . . . . 1.0 110.969 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.1 m -116.62 163.87 13.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 1.0 111.037 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.17 -160.25 31.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.676 -0.773 . . . . 1.0 112.67 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 t70 53.59 66.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 1.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.05 -2.09 82.31 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.963 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.59 116.62 11.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.652 0.263 . . . . 1.0 111.117 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.537 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.3 118.51 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.888 0.375 . . . . 1.0 110.879 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 88.0 m -51.23 138.92 19.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.93 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.46 146.04 0.76 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.482 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.4 t 34.8 -90.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.963 -0.562 . . . . 1.0 112.032 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.456 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.88 -30.58 2.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 1.0 111.034 179.764 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.1 p -179.44 71.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.858 0.361 . . . . 1.0 110.641 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.52 -91.01 1.75 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.757 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.17 168.25 24.6 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.442 2.094 . . . . 1.0 112.478 -179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -87.26 -175.06 5.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.84 164.92 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.868 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.8 m -54.1 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.01 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -93.5 118.46 31.37 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.668 -0.697 . . . . 1.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 115.16 -27.43 8.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.708 -0.758 . . . . 1.0 112.636 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.51 170.2 9.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.897 0.379 . . . . 1.0 110.892 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 15.0 m-85 -135.77 176.24 8.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.239 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 t -127.65 109.19 11.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.34 151.07 21.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 1.0 110.448 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.51 56.56 1.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 1.0 111.088 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -59.48 -175.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.839 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -61.28 85.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 1.0 111.006 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.35 145.12 0.43 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.862 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.02 54.34 5.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.67 2.247 . . . . 1.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.433 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 174.41 92.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.64 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.75 144.46 14.19 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.454 -0.339 . . . . 1.0 110.764 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.537 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.58 141.97 35.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.35 . . . . 1.0 111.023 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.458 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -114.09 122.22 46.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.219 179.431 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.66 172.02 16.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.291 -0.413 . . . . 1.0 111.125 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.5 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.8 t30 -46.0 168.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.455 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.441 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.59 -76.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.085 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 1.0 110.887 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.801 0.334 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.9 m -112.97 163.04 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.947 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.97 -160.02 30.06 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.573 -0.822 . . . . 1.0 112.738 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.58 52.5 12.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.872 0.368 . . . . 1.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.11 -0.16 83.62 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.858 -0.686 . . . . 1.0 112.949 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.29 126.46 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.74 0.305 . . . . 1.0 111.02 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 1.5 mpp_? -70.15 124.85 25.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.37 . . . . 1.0 110.835 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.9 m -57.97 138.97 55.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.268 -0.423 . . . . 1.0 110.605 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -45.38 143.62 1.73 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.393 . . . . 1.0 111.449 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.3 t 35.43 -89.31 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.985 -0.552 . . . . 1.0 112.128 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.461 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.15 -38.76 1.59 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.718 0.294 . . . . 1.0 110.802 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.3 p -177.12 69.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 1.0 110.787 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.06 -81.26 1.59 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.728 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.39 167.76 26.47 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.451 2.1 . . . . 1.0 112.44 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -89.05 -171.64 3.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.03 164.39 20.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.815 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.8 m -54.16 -176.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.157 0.503 . . . . 1.0 110.932 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -90.88 122.54 33.67 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 1.0 111.083 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.98 -26.3 17.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 1.0 112.661 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.4 m-30 -95.66 170.72 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.825 0.345 . . . . 1.0 111.059 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.444 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.5 m-85 -135.85 178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.595 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.4 t -127.53 105.94 8.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.974 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.48 170.27 10.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.704 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 m -147.18 68.27 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.318 -0.401 . . . . 1.0 110.881 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm-85 -62.04 -171.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.95 80.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.991 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.09 144.04 0.49 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.859 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.16 58.21 6.12 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.619 2.212 . . . . 1.0 112.449 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.78 97.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.844 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -58.98 147.17 35.43 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.706 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 1.0 111.087 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.02 125.55 54.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.327 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 173.23 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.134 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.493 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 39.5 t30 -45.0 167.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.501 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.444 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.72 -76.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.045 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.22 -0.895 . . . . 1.0 110.928 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.847 0.356 . . . . 1.0 110.941 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -99.46 143.39 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 1.0 110.854 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.29 174.05 44.22 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.45 -0.881 . . . . 1.0 113.032 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.27 75.21 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.874 0.369 . . . . 1.0 111.349 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 72.07 6.4 64.3 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.006 -0.616 . . . . 1.0 113.211 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.54 118.95 13.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.934 0.367 . . . . 1.0 111.215 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.18 109.52 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.661 179.581 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.73 139.72 12.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.383 -0.371 . . . . 1.0 110.902 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -45.51 141.29 2.78 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.59 -89.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.973 -0.558 . . . . 1.0 112.201 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.454 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.23 -36.42 2.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.722 0.296 . . . . 1.0 110.983 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -178.67 70.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.11 -91.05 1.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 1.0 112.647 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.58 168.33 23.93 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.467 2.111 . . . . 1.0 112.397 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -78.12 -175.32 4.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 t -117.67 165.25 13.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 66.1 m -53.62 -176.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 1.0 111.056 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -94.44 118.03 31.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.057 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.16 -29.47 9.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.583 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.3 m-30 -97.33 169.81 9.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.777 0.322 . . . . 1.0 110.831 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 12.2 m-85 -133.39 175.31 9.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 1.0 110.396 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.3 t -119.12 112.68 19.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.001 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -95.93 151.19 19.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.811 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.0 m -127.08 57.73 1.46 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 1.0 110.962 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -61.63 -171.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.834 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -62.81 83.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.056 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.93 143.53 0.49 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.806 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.77 53.42 4.77 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.709 2.273 . . . . 1.0 112.576 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER 177.33 90.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 1.0 110.82 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.2 m -55.26 142.76 30.43 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.889 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -112.77 153.79 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.947 0.403 . . . . 1.0 111.134 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -112.31 125.22 53.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.556 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -146.37 166.46 26.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.514 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.2 t30 -45.69 168.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 1.0 111.486 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.449 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.71 -77.02 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 1.0 111.073 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.29 -0.862 . . . . 1.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.865 0.364 . . . . 1.0 110.917 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.1 m -121.92 162.51 21.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.071 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.52 -159.12 30.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.598 -0.811 . . . . 1.0 112.851 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 t70 55.23 60.43 3.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 1.0 111.241 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.1 -0.58 83.13 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.826 -0.702 . . . . 1.0 112.955 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -70.25 133.61 47.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 1.0 111.25 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.43 124.7 24.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.687 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -58.19 144.56 40.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.542 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -51.81 141.23 17.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.49 -0.323 . . . . 1.0 111.048 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 35.42 -88.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.073 -0.512 . . . . 1.0 112.101 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.474 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.45 -39.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.75 0.31 . . . . 1.0 110.883 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 p -178.22 70.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.721 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.92 -81.81 1.62 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.702 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.21 168.25 25.22 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 122.347 2.032 . . . . 1.0 112.379 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -96.78 159.83 14.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.58 164.65 15.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -53.79 -176.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.96 113.93 22.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.976 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 113.31 -26.51 10.27 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.743 -0.741 . . . . 1.0 112.629 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.487 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.5 m-30 -95.48 170.89 9.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 1.0 111.023 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.438 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 22.0 m-85 -136.49 -179.3 5.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.683 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.9 t -126.02 119.05 26.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.948 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.2 m -101.48 166.91 10.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.492 . . . . 1.0 110.42 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.1 m -149.08 53.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.895 0.379 . . . . 1.0 111.065 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.55 -163.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 1.0 110.568 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -60.19 83.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.839 0.352 . . . . 1.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -177.85 131.21 0.32 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.71 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.96 -26.53 59.12 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 1.0 112.518 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.67 125.44 48.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.417 -0.356 . . . . 1.0 111.211 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.44 146.02 43.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.203 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 24' ' ' SER . 0.1 OUTLIER -108.12 160.85 15.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 1.0 111.436 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.408 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.36 130.43 32.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.189 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -164.13 173.71 12.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.771 0.319 . . . . 1.0 111.013 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 21.6 t30 -43.07 164.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.582 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.438 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.69 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.043 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.259 -0.876 . . . . 1.0 110.895 -179.952 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.875 0.369 . . . . 1.0 110.904 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m -85.45 149.5 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.231 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.16 -160.22 17.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 1.0 112.568 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.41 133.07 33.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.356 . . . . 1.0 110.959 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.06 -1.79 83.46 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.794 -0.717 . . . . 1.0 112.928 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.36 126.26 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.732 0.301 . . . . 1.0 111.144 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.439 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.11 121.49 17.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.792 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -59.02 142.37 51.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.762 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.85 142.38 3.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.422 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.013 -0.539 . . . . 1.0 112.19 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.29 -31.36 3.06 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 1.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -179.03 70.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.833 0.349 . . . . 1.0 110.851 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -92.95 -86.46 1.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.694 -0.765 . . . . 1.0 112.629 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.09 168.21 25.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.415 2.077 . . . . 1.0 112.378 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -99.28 173.1 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.81 165.3 12.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.911 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 84.4 m -53.95 -176.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.988 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.12 84.23 5.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.691 -0.686 . . . . 1.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.77 -25.8 2.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.672 -0.775 . . . . 1.0 112.674 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.469 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 4.1 m-30 -87.51 171.68 10.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.853 0.359 . . . . 1.0 110.98 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.436 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -138.54 178.97 6.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.0 110.589 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.6 t -129.76 114.83 16.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -102.7 173.92 6.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 1.0 110.959 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.5 m -145.13 66.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.868 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.46 -167.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.833 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -65.11 78.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.966 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.83 128.49 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.732 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -65.72 64.09 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.54 2.16 . . . . 1.0 112.334 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.79 94.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.796 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.6 m -57.21 134.68 56.13 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.946 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 153.65 20.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 1.0 111.005 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.3 128.42 54.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.448 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.48 172.23 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.032 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.469 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 35.0 t30 -46.74 169.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.0 111.447 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.436 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.6 p30 -69.72 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.077 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.209 -0.9 . . . . 1.0 110.91 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.82 0.343 . . . . 1.0 111.011 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p -112.63 164.01 13.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.5 m -84.26 142.83 12.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.181 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.13 -160.36 1.63 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 1.0 112.581 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.63 128.22 36.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.881 0.372 . . . . 1.0 110.961 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 86.89 -7.87 78.38 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.922 -0.656 . . . . 1.0 112.84 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.52 126.4 29.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.618 0.247 . . . . 1.0 110.907 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.583 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 43.2 mtt85 -70.32 144.62 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 1.0 111.11 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -72.88 136.69 45.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.909 -0.587 . . . . 1.0 110.529 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.423 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -38.16 149.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.293 -0.412 . . . . 1.0 111.772 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.1 t 37.17 -91.31 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.01 -0.541 . . . . 1.0 112.163 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.76 -29.62 1.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.626 0.25 . . . . 1.0 111.156 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.8 p -179.52 71.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.782 0.325 . . . . 1.0 110.747 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.57 -84.57 1.8 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.761 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 39.7 Cg_endo -67.37 168.73 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.442 2.095 . . . . 1.0 112.479 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -101.37 -173.35 2.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.957 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 166.17 11.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.809 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.415 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 73.4 m -53.39 -176.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.055 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -80.04 85.61 5.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.16 -25.63 3.16 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.663 -0.78 . . . . 1.0 112.713 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.496 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -85.57 170.21 12.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.903 0.382 . . . . 1.0 110.986 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.441 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 17.1 m-85 -137.82 176.85 8.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 1.0 110.358 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.1 t -126.66 108.21 10.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 1.0 111.009 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.99 166.43 15.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.366 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.17 64.37 0.96 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.939 0.4 . . . . 1.0 111.253 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' MET . 0.7 OUTLIER -61.49 -162.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.403 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.14 75.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.439 -0.346 . . . . 1.0 110.925 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 178.72 149.62 0.42 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.625 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.34 -45.71 0.79 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.52 2.147 . . . . 1.0 112.415 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.583 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER -71.03 95.4 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.803 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.7 m -62.85 155.22 27.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.683 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.52 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -111.15 142.59 43.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.307 . . . . 1.0 110.962 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -119.84 123.73 44.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.203 179.484 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.96 174.19 15.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.156 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.496 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.1 t30 -45.95 168.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.425 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.441 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.68 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.112 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -154.4 127.42 8.29 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 118.242 -0.885 . . . . 1.0 110.886 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.78 0 O-C-N 123.54 0.525 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.788 0.328 . . . . 1.0 111.068 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.1 p -129.03 164.51 23.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.5 m -86.89 154.27 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 1.0 111.258 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.51 -160.39 31.6 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.799 -0.715 . . . . 1.0 112.562 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.06 133.69 34.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 1.0 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.19 -1.11 81.96 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.89 -0.671 . . . . 1.0 112.813 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.39 124.57 24.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.73 0.3 . . . . 1.0 111.218 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.08 115.36 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 1.0 110.688 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.26 144.66 15.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.887 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.432 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -47.09 137.93 7.26 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.317 -0.401 . . . . 1.0 111.355 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.4 t 36.74 -90.83 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.988 -0.551 . . . . 1.0 112.177 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.432 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -123.3 -29.14 3.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.672 0.272 . . . . 1.0 111.172 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.23 71.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.876 0.369 . . . . 1.0 110.874 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.28 -88.49 1.41 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.774 -0.727 . . . . 1.0 112.589 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.57 168.43 24.44 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.424 2.083 . . . . 1.0 112.377 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -97.37 175.5 6.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.78 165.35 12.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.852 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.7 m -53.63 -176.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.99 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.76 84.17 4.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.703 -0.681 . . . . 1.0 110.954 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.26 -28.16 2.71 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.667 -0.778 . . . . 1.0 112.597 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.458 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 6.0 m-30 -83.77 174.04 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 1.0 110.939 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.457 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 26.2 m-85 -142.84 179.94 6.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 1.0 110.484 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -131.4 119.41 21.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.837 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.08 164.81 11.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.039 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.4 m -132.39 60.94 1.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -56.19 -170.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.043 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -64.27 78.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.125 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.01 141.59 0.29 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.798 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.8 58.85 6.16 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.532 2.155 . . . . 1.0 112.415 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -178.85 89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.888 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.0 m -55.26 132.69 48.41 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.935 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.66 154.96 18.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.096 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.74 126.61 52.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.304 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -153.88 172.42 17.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.481 -0.327 . . . . 1.0 111.039 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.458 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 37.1 t30 -46.41 169.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.458 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.457 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 1.0 111.007 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -104.45 132.61 50.5 Favored 'General case' 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.871 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.802 0 O-C-N 123.54 0.525 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.839 0.352 . . . . 1.0 111.053 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.0 p -125.54 165.42 18.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.9 m -90.41 144.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.077 -0.51 . . . . 1.0 111.274 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.24 -160.17 2.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.854 -0.689 . . . . 1.0 112.811 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.97 128.83 35.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.837 0.351 . . . . 1.0 111.009 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 79.62 -1.57 77.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.84 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -70.55 136.11 49.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 1.0 111.238 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 22.1 mmt-85 -70.41 130.7 42.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.308 -0.405 . . . . 1.0 110.647 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.8 m -64.72 146.31 54.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.233 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.41 ' CB ' ' CD ' ' A' ' 15' ' ' PRO . . . -44.94 144.9 1.07 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.611 -0.268 . . . . 1.0 111.288 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t 37.75 -92.09 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.138 -0.483 . . . . 1.0 112.018 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.409 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.83 -28.46 2.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.613 0.244 . . . . 1.0 111.141 179.735 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p 175.48 73.24 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 1.0 110.769 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.82 -82.32 1.6 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.777 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.97 168.66 23.31 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.457 2.105 . . . . 1.0 112.421 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -96.73 -172.38 2.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.82 166.87 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.412 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 72.6 m -52.58 -176.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.112 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.9 84.2 2.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.78 -26.92 3.56 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.648 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -84.96 170.45 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.821 0.343 . . . . 1.0 110.854 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 14.8 m-85 -140.19 174.52 10.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.484 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 30.6 t -115.2 118.02 32.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.691 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.5 m -101.04 166.04 11.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.688 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.41 59.52 1.02 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.925 0.393 . . . . 1.0 111.107 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 28' ' ' MET . 2.8 ttm180 -59.35 -163.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.64 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -61.32 81.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 1.0 110.919 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 179.21 148.62 0.43 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.682 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -74.55 -22.35 15.97 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.576 2.184 . . . . 1.0 112.529 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.424 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -94.93 104.45 16.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.125 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.6 m -64.76 143.85 57.65 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.391 -0.368 . . . . 1.0 110.116 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -110.76 168.91 9.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.086 0.469 . . . . 1.0 111.682 -179.239 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -140.1 125.59 19.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.615 -0.721 . . . . 1.0 110.175 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -153.63 174.2 14.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.908 0.385 . . . . 1.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.514 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.6 t30 -46.14 169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.518 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.3 p30 -69.59 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 1.0 111.103 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.0 t -146.65 138.75 24.79 Favored 'General case' 0 C--O 1.249 1.036 0 CA-C-O 118.256 -0.878 . . . . 1.0 110.875 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.737 0 O-C-N 123.528 0.518 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.86 0.362 . . . . 1.0 111.11 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.7 p -107.61 165.25 11.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 19.4 m -92.66 142.94 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.506 . . . . 1.0 111.152 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.53 -160.25 7.31 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.787 -0.721 . . . . 1.0 112.782 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.05 137.12 33.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.815 0.34 . . . . 1.0 110.931 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 76.46 3.23 77.21 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.852 -0.689 . . . . 1.0 112.859 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.38 122.73 20.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.71 0.29 . . . . 1.0 111.109 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.579 ' HG2' ' CG ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -69.95 107.82 3.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.58 179.62 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.9 m -48.14 134.77 13.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.781 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.4 147.93 0.52 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.375 -0.375 . . . . 1.0 111.361 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.99 -89.56 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.02 -0.536 . . . . 1.0 112.055 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.464 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.04 -31.87 3.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.623 0.249 . . . . 1.0 111.088 179.724 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -178.25 70.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.909 0.385 . . . . 1.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.59 -89.86 1.76 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.883 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.424 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 52.6 Cg_exo -54.43 156.4 14.13 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.461 2.107 . . . . 1.0 112.54 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -101.75 146.37 27.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.656 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 161.63 27.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 1.0 111.005 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.53 -176.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.098 0.475 . . . . 1.0 110.992 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.73 85.27 2.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.861 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.56 -28.13 2.9 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.533 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.48 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.6 m-30 -85.41 173.79 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.862 0.363 . . . . 1.0 110.956 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.454 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 28.7 m-85 -145.08 179.11 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.995 -0.548 . . . . 1.0 110.376 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.7 t -120.46 116.33 25.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.582 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.91 162.94 13.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.053 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 39.2 m -150.02 69.9 1.03 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.735 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 ttm-85 -71.21 63.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.044 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m 48.97 81.6 0.05 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.254 -0.43 . . . . 1.0 111.256 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -156.48 169.54 10.35 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.905 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -92.05 25.52 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.123 2.548 . . . . 1.0 112.458 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.579 ' CG ' ' HG2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -174.55 93.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.588 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.4 m -56.02 153.04 9.41 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.005 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.2 ptt85 -115.77 161.4 18.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.975 0.417 . . . . 1.0 111.216 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 126.43 44.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.0 110.428 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.2 173.4 15.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.94 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.48 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 47.1 t30 -45.85 168.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 1.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.454 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.2 p30 -69.7 -76.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.004 -0.544 . . . . 1.0 111.058 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.4 t -110.45 140.66 44.47 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-O 118.236 -0.888 . . . . 1.0 110.907 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.761 0 O-C-N 123.544 0.527 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.836 0.35 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.6 p -109.46 164.48 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.962 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.6 m -84.74 148.46 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 1.0 111.217 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.59 -160.22 4.13 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.802 -0.714 . . . . 1.0 112.623 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.6 136.33 33.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.862 0.363 . . . . 1.0 110.931 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 74.47 5.59 73.37 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.907 -0.663 . . . . 1.0 112.83 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.5 120.68 16.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.702 0.287 . . . . 1.0 111.089 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.423 ' HG3' ' CD1' ' A' ' 30' ' ' TYR . 3.4 ptp180 -70.27 120.82 16.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.362 . . . . 1.0 110.642 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.8 m -56.17 142.4 37.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.857 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.437 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -48.92 147.48 2.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.339 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 33.93 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.995 -0.548 . . . . 1.0 112.166 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -30.32 2.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.734 0.302 . . . . 1.0 111.136 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -178.58 70.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.881 0.372 . . . . 1.0 110.756 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.76 -85.66 1.72 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.718 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.63 168.21 23.33 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.449 2.099 . . . . 1.0 112.39 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -99.32 -176.65 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.954 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 165.47 12.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.7 m -53.89 -175.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.038 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.26 88.52 7.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.988 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.21 -25.0 3.2 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.67 -0.776 . . . . 1.0 112.806 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -87.48 170.08 11.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.872 0.368 . . . . 1.0 111.055 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.436 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.7 m-85 -137.67 174.33 10.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.397 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 40.9 t -127.41 109.81 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 1.0 110.999 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -96.57 159.5 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.776 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.1 m -129.87 59.42 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 1.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.1 -169.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.079 -0.509 . . . . 1.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -63.23 82.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 1.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.52 144.83 0.41 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.843 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.6 54.93 5.42 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.631 2.221 . . . . 1.0 112.476 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.423 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER 176.55 97.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 1.0 110.782 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.3 m -54.94 140.61 36.68 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.336 -0.393 . . . . 1.0 110.96 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.413 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.43 142.68 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.983 -179.687 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -110.85 124.4 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 1.0 110.477 179.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -149.19 171.52 16.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.028 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.492 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.7 t30 -51.26 170.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.206 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.436 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.63 -77.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 1.0 111.066 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.6 t -117.36 128.24 54.84 Favored 'General case' 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 1.0 110.872 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.785 0 O-C-N 123.513 0.508 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.847 0.356 . . . . 1.0 111.072 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -82.81 164.81 20.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.4 m -91.85 143.42 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 1.0 111.386 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.19 -160.32 0.82 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.766 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 21' ' ' TYR . 1.2 m-20 -88.33 128.62 35.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.876 0.369 . . . . 1.0 111.076 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 84.89 -7.59 73.79 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.92 -0.657 . . . . 1.0 112.892 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -70.87 131.0 43.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.636 0.255 . . . . 1.0 111.145 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.814 ' CD ' ' CG ' ' A' ' 30' ' ' TYR . 45.3 mtm-85 -70.11 143.42 52.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.73 0.3 . . . . 1.0 110.582 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.7 m -73.54 151.61 40.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.414 -0.357 . . . . 1.0 110.231 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.443 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -45.17 148.05 0.65 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.578 -0.283 . . . . 1.0 111.385 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 36.26 -89.57 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.081 -0.508 . . . . 1.0 112.061 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.443 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.9 -35.17 2.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.74 0.305 . . . . 1.0 110.873 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p 179.63 70.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 1.0 110.722 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -96.57 -82.35 1.62 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.814 -0.708 . . . . 1.0 112.669 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.405 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 56.2 Cg_endo -70.5 166.1 29.63 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.439 2.093 . . . . 1.0 112.349 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.69 -174.48 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.9 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 166.88 10.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.84 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 97.0 m -52.6 -176.66 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 1.0 111.127 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.58 83.31 2.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.581 -0.736 . . . . 1.0 110.882 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 134.66 -25.47 3.41 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.495 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -87.32 170.57 11.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.844 0.354 . . . . 1.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.456 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.7 m-85 -138.64 177.68 7.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.615 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 12.9 t -124.43 111.02 15.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.98 -0.555 . . . . 1.0 110.881 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.0 172.04 7.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.704 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 m -147.27 68.55 1.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.344 -0.389 . . . . 1.0 110.773 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -58.15 -171.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.075 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -64.85 78.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER 175.31 128.52 0.13 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.687 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.39 73.65 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 1.0 112.349 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.814 ' CG ' ' CD ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 175.88 92.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.795 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.8 m -60.53 132.11 52.88 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.551 -0.295 . . . . 1.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -101.53 153.24 19.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.76 0.314 . . . . 1.0 111.138 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -122.3 123.61 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.308 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.77 174.42 15.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.332 -0.395 . . . . 1.0 111.185 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.495 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.0 t30 -44.55 167.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.656 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.65 -77.34 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.015 -0.539 . . . . 1.0 111.11 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 t -130.65 136.26 48.65 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 118.18 -0.914 . . . . 1.0 110.94 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.777 0 O-C-N 123.573 0.546 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.825 0.345 . . . . 1.0 111.01 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.2 p -128.96 164.85 22.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.964 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.7 m -115.94 143.41 25.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.905 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.54 -158.79 30.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.441 -0.885 . . . . 1.0 112.895 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 55.26 58.84 4.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.387 . . . . 1.0 111.156 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.65 3.71 73.5 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.928 -0.654 . . . . 1.0 112.977 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.52 131.05 43.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 1.0 111.213 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.39 124.28 23.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.689 179.509 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -60.19 137.95 58.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.563 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -47.46 146.71 1.96 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.404 . . . . 1.0 111.302 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t 34.78 -88.95 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.089 -0.505 . . . . 1.0 112.048 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.47 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.92 -36.08 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.745 0.307 . . . . 1.0 110.931 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 p -179.31 71.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 1.0 110.72 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -101.02 -85.69 1.88 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.858 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.07 165.54 6.78 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.365 2.044 . . . . 1.0 112.392 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -100.12 146.85 26.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.651 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.8 158.95 30.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.893 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.9 m -54.14 -176.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.077 0.465 . . . . 1.0 110.961 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -85.45 107.21 17.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.027 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.51 -26.31 7.36 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.739 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.506 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.65 170.18 9.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 1.0 110.938 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.449 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.2 m-85 -136.76 178.79 6.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.684 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -123.31 118.69 28.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.825 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.06 129.32 46.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.846 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.9 m -106.34 47.48 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 1.0 110.821 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -57.91 -166.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.942 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -62.72 81.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 1.0 111.014 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.2 126.38 0.25 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 1.0 110.734 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.95 -27.31 44.2 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.416 2.077 . . . . 1.0 112.281 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.02 95.42 5.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.951 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.5 m -55.74 149.32 14.65 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.836 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 16.6 mtt85 -107.03 160.78 15.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.953 0.406 . . . . 1.0 111.136 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -131.6 127.78 37.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.196 179.646 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.29 174.47 14.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.741 0.305 . . . . 1.0 111.127 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.506 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.3 t-20 -43.07 165.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.449 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.57 -76.41 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.971 -0.559 . . . . 1.0 111.109 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 t -131.96 130.77 41.91 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 118.254 -0.879 . . . . 1.0 110.906 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.782 0 O-C-N 123.523 0.514 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.85 0.357 . . . . 1.0 111.058 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.18 164.71 12.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.885 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.11 148.63 4.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.296 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.73 -160.21 19.8 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.807 -0.711 . . . . 1.0 112.645 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -81.6 138.44 35.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.364 . . . . 1.0 111.031 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.42 9.93 59.09 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.956 -0.64 . . . . 1.0 112.814 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.47 127.64 33.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.682 0.277 . . . . 1.0 111.306 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.16 111.37 5.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.387 -0.37 . . . . 1.0 110.516 179.372 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 24.6 m -52.75 138.95 27.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.854 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.78 147.15 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.466 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 33.84 -89.2 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.121 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.46 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.83 -34.73 1.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.677 0.275 . . . . 1.0 110.96 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 p -177.7 70.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.404 . . . . 1.0 110.844 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.01 -81.3 1.58 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.751 -0.738 . . . . 1.0 112.749 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.401 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 51.5 Cg_endo -69.41 168.19 21.81 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.447 2.098 . . . . 1.0 112.46 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -97.4 -168.3 1.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.75 166.38 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.982 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 88.9 m -53.16 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.046 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -81.96 83.85 7.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.71 -0.677 . . . . 1.0 110.866 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.76 -26.61 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.613 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.05 170.16 10.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 1.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.455 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.5 m-85 -138.57 173.82 11.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.402 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.79 113.83 26.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.291 -0.413 . . . . 1.0 110.772 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.1 164.46 12.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.694 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.4 m -150.9 65.73 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.034 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -66.72 -163.95 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.66 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -63.44 80.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 1.0 110.911 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.37 155.04 5.98 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.824 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.55 -37.2 3.27 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.206 . . . . 1.0 112.415 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.17 122.82 40.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.047 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 36.7 m -72.01 162.65 29.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.391 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.77 172.47 11.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.087 0.47 . . . . 1.0 111.517 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.414 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -135.3 128.43 31.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.297 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -147.74 171.18 16.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.767 0.318 . . . . 1.0 111.065 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.502 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.6 t30 -50.5 170.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 1.0 111.257 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.455 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.65 -76.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.062 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.15 -35.09 10.89 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 118.2 -0.905 . . . . 1.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.801 0 O-C-N 123.554 0.533 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.796 0.331 . . . . 1.0 111.039 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -132.72 164.13 27.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.9 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.4 m -91.94 144.14 9.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.084 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.71 -160.32 13.45 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.766 -0.731 . . . . 1.0 112.663 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.93 138.8 33.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.79 0.328 . . . . 1.0 110.963 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.68 3.07 71.73 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.863 -0.684 . . . . 1.0 112.933 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.35 120.12 15.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.725 0.297 . . . . 1.0 111.112 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HG2' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.1 106.57 3.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.599 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 96.3 m -48.06 133.96 14.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.314 -0.403 . . . . 1.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.437 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -42.84 144.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.87 -90.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.931 -0.577 . . . . 1.0 112.117 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.58 -25.85 3.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.633 0.254 . . . . 1.0 111.238 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 p 178.92 71.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.856 0.36 . . . . 1.0 110.905 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.01 -95.72 1.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.631 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -53.18 164.3 1.88 Allowed 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.311 2.008 . . . . 1.0 112.444 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -107.08 149.41 27.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 160.27 33.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.86 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.74 -176.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.978 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -77.02 84.25 3.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.911 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 139.27 -27.07 2.66 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.754 -0.736 . . . . 1.0 112.607 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.468 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.2 m-30 -88.07 173.3 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.847 0.356 . . . . 1.0 110.943 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 24.5 m-85 -141.68 179.2 6.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.419 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.0 t -125.83 114.17 18.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.811 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.89 154.01 17.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 1.0 110.948 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.15 57.53 1.39 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.874 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -175.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.9 82.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.958 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.78 145.15 0.46 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.812 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -79.69 54.74 5.33 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.691 2.261 . . . . 1.0 112.46 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.447 ' CD1' ' HG2' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.85 89.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.777 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.8 m -55.03 144.41 23.59 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.918 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.24 158.01 19.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.953 0.406 . . . . 1.0 111.031 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.93 127.64 54.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.604 179.842 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -152.54 171.66 17.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.855 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.468 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 29.6 t30 -47.09 170.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 1.0 111.361 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.6 -76.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.088 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -129.89 121.76 27.28 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 118.249 -0.882 . . . . 1.0 110.885 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.787 0 O-C-N 123.576 0.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.779 0.323 . . . . 1.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.8 p -106.5 165.2 11.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -132.77 143.44 39.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.971 -0.558 . . . . 1.0 110.935 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.437 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 178.34 -158.06 22.46 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.438 -0.887 . . . . 1.0 113.001 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 56.55 66.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.909 0.385 . . . . 1.0 111.147 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.27 -2.73 80.63 Favored Glycine 0 CA--C 1.52 0.347 0 C-N-CA 120.948 -0.644 . . . . 1.0 112.912 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.57 119.09 14.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.724 0.262 . . . . 1.0 111.182 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 2.7 ptp180 -70.26 119.19 14.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.946 0.403 . . . . 1.0 110.623 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.69 140.41 23.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.035 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.59 147.89 1.12 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.254 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.939 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.457 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.32 -24.41 3.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.635 0.255 . . . . 1.0 111.1 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 p 175.02 73.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.824 0.345 . . . . 1.0 110.708 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.73 -94.12 2.02 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.753 -0.737 . . . . 1.0 112.902 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -55.98 161.21 8.86 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.357 2.038 . . . . 1.0 112.466 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -96.19 152.58 18.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.678 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.14 156.85 28.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 1.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 74.4 m -53.76 -176.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.105 0.479 . . . . 1.0 110.959 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.16 93.96 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.782 -0.645 . . . . 1.0 111.036 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.45 3.52 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.656 -0.783 . . . . 1.0 112.778 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.15 170.1 9.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 1.0 111.05 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.451 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.3 m-85 -137.3 179.12 6.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.372 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 t -126.24 113.76 17.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.455 . . . . 1.0 111.004 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.45 139.43 32.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.529 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.5 m -116.19 52.38 0.92 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.962 0.411 . . . . 1.0 111.006 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.8 ttm180 -58.46 -163.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.769 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.57 81.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.487 -0.324 . . . . 1.0 110.978 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 178.96 147.8 0.4 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.726 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.79 -34.67 6.56 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.548 2.165 . . . . 1.0 112.252 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.449 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -97.01 96.45 8.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.835 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.4 m -55.45 151.55 10.06 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.492 -0.322 . . . . 1.0 110.731 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -108.58 142.39 39.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.884 0.373 . . . . 1.0 111.115 -179.546 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.437 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -114.22 124.02 51.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.122 179.453 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.31 174.05 15.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.157 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.503 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.8 t30 -43.2 165.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.462 . . . . 1.0 111.675 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.451 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.56 -77.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.091 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.71 126.31 44.29 Favored 'General case' 0 C--O 1.249 1.06 0 CA-C-O 118.231 -0.89 . . . . 1.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.779 0 CA-C-N 118.295 0.498 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.866 0.365 . . . . 1.0 110.992 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.6 p -147.46 165.6 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 1.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.88 149.16 26.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.894 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.427 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 167.59 -158.4 31.24 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.37 -0.919 . . . . 1.0 112.905 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 56.13 58.74 4.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.385 . . . . 1.0 111.216 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.23 -0.52 83.85 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.824 -0.703 . . . . 1.0 113.011 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.26 129.32 39.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.778 0.323 . . . . 1.0 111.264 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.49 122.9 20.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 1.0 110.585 179.541 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 7.5 m -55.54 141.22 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.496 -0.32 . . . . 1.0 110.614 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -49.24 145.16 4.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.363 -0.38 . . . . 1.0 111.216 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.85 -89.0 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.042 -0.526 . . . . 1.0 112.053 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.471 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -35.83 2.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.731 0.301 . . . . 1.0 111.01 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.7 p -179.57 71.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.889 0.376 . . . . 1.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.29 -87.48 1.93 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.739 -0.744 . . . . 1.0 112.735 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.77 168.26 5.82 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.401 2.068 . . . . 1.0 112.36 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -105.12 147.11 28.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.634 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.64 158.06 36.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.863 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.7 m -53.84 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.107 0.48 . . . . 1.0 111.079 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -82.6 105.06 13.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.974 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.08 -25.94 6.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.652 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.02 170.53 9.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.788 0.328 . . . . 1.0 110.959 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.447 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -136.48 179.85 6.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.696 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.5 t -126.31 114.83 18.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -99.02 168.84 9.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.428 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.3 m -148.71 66.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.912 0.387 . . . . 1.0 111.189 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -162.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.55 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.8 m -67.21 66.95 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 5.2 mmt -159.98 135.46 5.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.729 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.17 -29.52 75.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.398 2.065 . . . . 1.0 112.432 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.21 119.72 36.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 1.0 111.126 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.3 m -71.84 151.01 43.77 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.291 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -110.44 154.91 22.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.858 0.361 . . . . 1.0 111.267 -179.282 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.427 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -131.1 127.54 38.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.068 -0.514 . . . . 1.0 110.1 179.406 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -162.29 173.78 13.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.747 0.308 . . . . 1.0 111.154 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.503 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 40.8 t30 -43.16 165.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.709 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.447 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.58 -76.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.096 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.59 125.71 53.68 Favored 'General case' 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 1.0 110.926 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.797 0 O-C-N 123.533 0.52 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.835 0.35 . . . . 1.0 111.031 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.92 164.32 12.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.943 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m -81.98 147.29 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.15 -160.11 7.98 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.85 -0.69 . . . . 1.0 112.623 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.98 138.76 33.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.863 0.363 . . . . 1.0 110.995 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.92 12.75 58.07 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.864 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.4 127.77 33.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 1.0 111.09 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.2 111.22 5.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.623 179.554 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' CE1' ' A' ' 30' ' ' TYR . 70.5 m -52.87 134.44 37.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.744 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -43.68 143.88 0.92 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.575 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.17 -90.13 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.945 -0.57 . . . . 1.0 112.151 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.445 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.39 -30.46 1.91 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.663 0.268 . . . . 1.0 111.262 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -178.71 70.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.819 0.342 . . . . 1.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.65 -84.0 1.75 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.755 -0.736 . . . . 1.0 112.743 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.41 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 57.6 Cg_endo -71.61 168.56 23.3 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.472 2.115 . . . . 1.0 112.443 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -97.51 -170.8 2.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.964 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.55 165.75 12.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.6 m -53.51 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 1.0 111.059 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.84 84.22 7.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.877 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.01 -26.6 2.6 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.703 -0.761 . . . . 1.0 112.594 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.7 m-30 -90.38 169.82 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.34 . . . . 1.0 110.939 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.2 m-85 -137.2 174.17 10.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.432 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 51.8 t -113.29 113.21 24.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.312 -0.403 . . . . 1.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 t -94.16 167.47 11.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 1.0 110.665 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 62.8 m -150.62 63.86 0.94 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.956 0.408 . . . . 1.0 111.085 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -63.31 -163.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.604 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.17 81.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 1.0 110.871 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.28 149.69 0.68 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.848 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.95 -36.68 7.29 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 1.0 112.371 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.452 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER -90.19 112.21 23.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.932 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.01 162.16 22.7 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.555 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.418 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -126.29 170.22 12.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.009 0.433 . . . . 1.0 111.387 -179.634 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.06 129.53 34.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.796 -0.638 . . . . 1.0 110.409 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -151.13 169.97 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 1.0 110.976 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.499 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.9 t30 -49.09 170.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 1.0 111.276 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.67 -76.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.999 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.4 p -150.49 136.14 18.18 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 118.174 -0.917 . . . . 1.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.248 -3.809 0 O-C-N 123.603 0.565 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.854 0.359 . . . . 1.0 111.04 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.423 ' HB2' ' N ' ' A' ' 18' ' ' CYS . 27.9 p -125.91 166.55 16.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.983 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -93.25 164.76 2.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.096 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.71 -160.71 32.45 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.859 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -88.19 132.48 34.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.891 0.377 . . . . 1.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.39 6.96 59.59 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.961 -0.637 . . . . 1.0 112.826 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.97 129.48 39.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.584 0.231 . . . . 1.0 111.23 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.499 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.37 112.22 6.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.969 0.414 . . . . 1.0 110.562 179.507 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.2 m -50.51 139.84 15.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.312 -0.404 . . . . 1.0 110.856 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.31 145.84 0.76 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.404 -0.362 . . . . 1.0 111.314 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 35.49 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.729 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.462 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -142.48 5.03 1.6 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.473 0.175 . . . . 1.0 111.473 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 12' ' ' TRP . 1.7 p 163.31 77.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.717 0.294 . . . . 1.0 110.558 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.66 -100.06 2.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.602 -0.809 . . . . 1.0 113.063 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.407 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 50.5 Cg_exo -53.15 165.95 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.426 2.084 . . . . 1.0 112.705 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -108.94 149.39 29.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 1.0 110.618 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.09 157.35 38.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 1.0 111.026 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.423 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 76.1 m -62.45 -176.62 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.914 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.43 94.04 2.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.98 -9.24 7.12 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.739 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 2.0 m-85 -110.62 170.75 7.89 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.749 0.309 . . . . 1.0 110.775 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.453 ' CD2' ' HA ' ' A' ' 36' ' ' ASN . 18.5 m-85 -142.44 173.64 11.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.266 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.4 t -117.35 114.43 23.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.25 -0.432 . . . . 1.0 111.188 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -95.77 169.47 9.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.37 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 85.3 m -151.32 70.29 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 1.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -62.12 -164.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.635 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -69.5 65.06 0.18 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.903 0.382 . . . . 1.0 111.159 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 9.1 mmt -155.83 157.12 31.3 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.788 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.48 -45.52 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.514 2.142 . . . . 1.0 112.378 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.54 107.57 16.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 1.0 110.857 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.6 m -61.21 167.6 3.03 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.253 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.499 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -128.21 164.25 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.085 0.469 . . . . 1.0 111.795 -179.413 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.443 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.21 124.96 23.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.189 179.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -145.21 172.68 12.78 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.831 0.348 . . . . 1.0 111.096 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.449 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 19.3 t30 -50.97 171.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.923 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.453 ' HA ' ' CD2' ' A' ' 22' ' ' TYR . 1.4 p30 -69.9 -77.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.985 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 m -133.68 124.16 26.25 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-O 118.194 -0.908 . . . . 1.0 110.887 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.782 0 O-C-N 123.545 0.528 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.794 0.331 . . . . 1.0 111.071 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.9 p -164.49 163.91 21.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.93 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.3 m -92.63 145.27 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 1.0 111.129 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.05 -160.95 8.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.811 -0.709 . . . . 1.0 112.715 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.71 135.0 33.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 1.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.01 0.87 77.6 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 1.0 112.772 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.45 128.39 36.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.726 0.298 . . . . 1.0 111.229 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.32 115.5 9.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 1.0 110.556 179.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 64.1 m -55.77 135.65 51.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.436 -0.347 . . . . 1.0 110.561 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.55 146.44 0.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.543 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.38 -90.03 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.042 -0.527 . . . . 1.0 111.986 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.65 -23.75 3.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.599 0.238 . . . . 1.0 111.305 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p 177.36 72.54 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.885 0.374 . . . . 1.0 110.764 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.19 -94.24 2.06 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.822 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.419 ' CD ' ' CB ' ' A' ' 10' ' ' ALA . 51.3 Cg_exo -53.48 165.1 1.73 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.353 2.035 . . . . 1.0 112.574 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -108.49 149.44 28.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.653 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 157.22 38.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -57.28 -176.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.088 0.47 . . . . 1.0 110.957 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -75.68 87.47 2.74 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 135.75 -27.31 3.08 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.33 170.45 9.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.723 0.297 . . . . 1.0 110.783 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.472 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.1 m-85 -139.71 173.59 11.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.572 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.2 t -111.43 112.99 25.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.687 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.94 166.03 12.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.695 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.5 m -151.22 66.42 0.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.985 0.422 . . . . 1.0 110.993 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -68.17 -163.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.663 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -63.83 79.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.1 141.07 0.42 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.778 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.02 -62.68 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.469 2.112 . . . . 1.0 112.294 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.88 115.02 6.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.999 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.1 m -69.6 169.32 12.93 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.326 -0.397 . . . . 1.0 110.329 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.1 170.02 14.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.07 0.462 . . . . 1.0 111.467 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.419 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -139.43 126.89 21.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.394 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.27 173.34 15.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 1.0 111.054 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.514 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 33.3 t30 -47.51 170.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.406 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.472 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.2 p30 -69.54 -76.43 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 1.0 111.042 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.4 136.2 53.88 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.788 0 O-C-N 123.547 0.529 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.823 0.344 . . . . 1.0 111.041 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p -137.21 163.52 30.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 1.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 m -111.83 162.96 9.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.058 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.16 -160.32 31.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.645 -0.788 . . . . 1.0 112.595 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 53.13 63.75 2.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.883 0.373 . . . . 1.0 111.074 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.39 2.02 83.08 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.901 -0.666 . . . . 1.0 112.871 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -70.34 123.2 21.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.736 0.303 . . . . 1.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.18 122.78 20.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.814 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 79.8 m -59.62 142.11 53.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.521 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.18 140.6 3.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.371 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.21 -90.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.005 -0.543 . . . . 1.0 112.098 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.81 -29.74 2.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.697 0.284 . . . . 1.0 111.129 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p 178.23 72.14 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 1.0 110.771 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.45 -91.58 1.57 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.701 -0.762 . . . . 1.0 112.74 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.19 168.53 24.5 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.471 2.114 . . . . 1.0 112.466 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -81.62 -170.49 2.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.38 165.79 20.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.505 . . . . 1.0 110.796 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.8 m -53.68 -176.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.99 -0.55 . . . . 1.0 111.045 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -93.59 124.75 37.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.749 -0.659 . . . . 1.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.85 -27.69 14.11 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.709 -0.757 . . . . 1.0 112.623 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.498 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.67 170.32 9.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.838 0.351 . . . . 1.0 110.933 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.442 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 16.3 m-85 -135.82 177.19 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.053 -0.522 . . . . 1.0 110.411 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.7 t -127.67 110.69 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.973 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -99.2 170.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.68 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.6 m -142.17 65.75 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -60.08 -168.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.91 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 m -64.99 78.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.034 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.406 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER 179.71 129.74 0.24 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.725 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 18.9 Cg_exo -66.26 63.76 0.49 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.527 2.152 . . . . 1.0 112.307 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 177.13 94.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.861 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -56.97 136.36 56.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.782 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.97 142.64 34.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.94 0.4 . . . . 1.0 111.095 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -109.11 124.97 51.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.422 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -153.04 170.83 19.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.446 -0.343 . . . . 1.0 111.014 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.498 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.3 t30 -46.39 168.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.332 -0.394 . . . . 1.0 111.454 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.442 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.72 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 1.0 111.077 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.5 t -104.97 139.42 39.69 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-O 118.272 -0.87 . . . . 1.0 110.896 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.763 0 O-C-N 123.479 0.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.858 0.361 . . . . 1.0 111.009 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p -133.81 164.13 27.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.969 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.1 m -116.62 163.87 13.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 1.0 111.037 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.17 -160.25 31.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.676 -0.773 . . . . 1.0 112.67 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 t70 53.59 66.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 1.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.05 -2.09 82.31 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.963 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.59 116.62 11.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.652 0.263 . . . . 1.0 111.117 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.537 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.3 118.51 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.888 0.375 . . . . 1.0 110.879 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 88.0 m -51.23 138.92 19.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.93 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.46 146.04 0.76 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.482 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.4 t 34.8 -90.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.963 -0.562 . . . . 1.0 112.032 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.456 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.88 -30.58 2.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 1.0 111.034 179.764 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.1 p -179.44 71.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.858 0.361 . . . . 1.0 110.641 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.52 -91.01 1.75 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.757 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.17 168.25 24.6 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.442 2.094 . . . . 1.0 112.478 -179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -87.26 -175.06 5.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.84 164.92 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.868 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.8 m -54.1 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.01 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -93.5 118.46 31.37 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.668 -0.697 . . . . 1.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 115.16 -27.43 8.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.708 -0.758 . . . . 1.0 112.636 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.51 170.2 9.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.897 0.379 . . . . 1.0 110.892 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.446 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 15.0 m-85 -135.77 176.24 8.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.239 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 t -127.65 109.19 11.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.34 151.07 21.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 1.0 110.448 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.51 56.56 1.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 1.0 111.088 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -59.48 -175.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.839 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -61.28 85.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 1.0 111.006 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.35 145.12 0.43 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.862 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.02 54.34 5.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.67 2.247 . . . . 1.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.433 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 174.41 92.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.64 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.75 144.46 14.19 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.454 -0.339 . . . . 1.0 110.764 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.537 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.58 141.97 35.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.35 . . . . 1.0 111.023 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.458 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -114.09 122.22 46.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.219 179.431 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.66 172.02 16.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.291 -0.413 . . . . 1.0 111.125 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.5 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.8 t30 -46.0 168.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.455 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.441 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.59 -76.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.085 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.36 132.16 55.7 Favored 'General case' 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 1.0 110.887 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.248 -3.808 0 O-C-N 123.519 0.512 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.851 0.358 . . . . 1.0 111.029 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p -129.72 164.17 24.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.964 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.9 m -112.97 163.04 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.947 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.97 -160.02 30.06 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.573 -0.822 . . . . 1.0 112.738 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.58 52.5 12.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.872 0.368 . . . . 1.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.11 -0.16 83.62 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.858 -0.686 . . . . 1.0 112.949 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.29 126.46 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.74 0.305 . . . . 1.0 111.02 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 1.5 mpp_? -70.15 124.85 25.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.37 . . . . 1.0 110.835 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.9 m -57.97 138.97 55.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.268 -0.423 . . . . 1.0 110.605 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -45.38 143.62 1.73 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.393 . . . . 1.0 111.449 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.3 t 35.43 -89.31 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.985 -0.552 . . . . 1.0 112.128 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.461 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.15 -38.76 1.59 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.718 0.294 . . . . 1.0 110.802 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.3 p -177.12 69.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 1.0 110.787 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.06 -81.26 1.59 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.728 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.39 167.76 26.47 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.451 2.1 . . . . 1.0 112.44 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -89.05 -171.64 3.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.03 164.39 20.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.815 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.8 m -54.16 -176.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.157 0.503 . . . . 1.0 110.932 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -90.88 122.54 33.67 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 1.0 111.083 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.98 -26.3 17.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 1.0 112.661 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.4 m-30 -95.66 170.72 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.825 0.345 . . . . 1.0 111.059 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.444 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.5 m-85 -135.85 178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.595 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.4 t -127.53 105.94 8.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.974 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.48 170.27 10.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.704 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 m -147.18 68.27 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.318 -0.401 . . . . 1.0 110.881 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm-85 -62.04 -171.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.95 80.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.991 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.09 144.04 0.49 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.859 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.16 58.21 6.12 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.619 2.212 . . . . 1.0 112.449 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.78 97.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.844 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -58.98 147.17 35.43 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.706 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 1.0 111.087 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.02 125.55 54.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.327 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 173.23 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.134 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.493 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 39.5 t30 -45.0 167.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.501 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.444 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.72 -76.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.045 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 p -131.88 134.12 45.37 Favored 'General case' 0 C--O 1.249 1.042 0 CA-C-O 118.22 -0.895 . . . . 1.0 110.928 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.766 0 O-C-N 123.53 0.519 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.802 0.334 . . . . 1.0 111.086 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p -145.08 163.69 33.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.941 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -99.46 143.39 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 1.0 110.854 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.29 174.05 44.22 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.45 -0.881 . . . . 1.0 113.032 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.27 75.21 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.874 0.369 . . . . 1.0 111.349 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 72.07 6.4 64.3 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.006 -0.616 . . . . 1.0 113.211 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.54 118.95 13.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.934 0.367 . . . . 1.0 111.215 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.18 109.52 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.661 179.581 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.73 139.72 12.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.383 -0.371 . . . . 1.0 110.902 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -45.51 141.29 2.78 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.59 -89.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.973 -0.558 . . . . 1.0 112.201 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.454 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.23 -36.42 2.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.722 0.296 . . . . 1.0 110.983 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -178.67 70.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.11 -91.05 1.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 1.0 112.647 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.58 168.33 23.93 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.467 2.111 . . . . 1.0 112.397 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -78.12 -175.32 4.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 t -117.67 165.25 13.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 66.1 m -53.62 -176.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 1.0 111.056 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -94.44 118.03 31.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.057 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.16 -29.47 9.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.583 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.3 m-30 -97.33 169.81 9.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.777 0.322 . . . . 1.0 110.831 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 12.2 m-85 -133.39 175.31 9.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 1.0 110.396 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.3 t -119.12 112.68 19.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.001 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -95.93 151.19 19.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.811 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.0 m -127.08 57.73 1.46 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 1.0 110.962 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -61.63 -171.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.834 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -62.81 83.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.056 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.93 143.53 0.49 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.806 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.77 53.42 4.77 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.709 2.273 . . . . 1.0 112.576 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER 177.33 90.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 1.0 110.82 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.2 m -55.26 142.76 30.43 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.889 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -112.77 153.79 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.947 0.403 . . . . 1.0 111.134 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -112.31 125.22 53.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.556 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -146.37 166.46 26.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.514 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.2 t30 -45.69 168.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 1.0 111.486 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.449 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.71 -77.02 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 1.0 111.073 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.4 130.25 45.66 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-O 118.29 -0.862 . . . . 1.0 110.921 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.748 0 O-C-N 123.503 0.502 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.815 0.34 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -140.82 164.5 30.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.917 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.1 m -121.92 162.51 21.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.071 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.52 -159.12 30.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.598 -0.811 . . . . 1.0 112.851 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 t70 55.23 60.43 3.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 1.0 111.241 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.1 -0.58 83.13 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.826 -0.702 . . . . 1.0 112.955 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -70.25 133.61 47.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 1.0 111.25 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.43 124.7 24.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.687 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -58.19 144.56 40.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.542 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -51.81 141.23 17.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.49 -0.323 . . . . 1.0 111.048 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 35.42 -88.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.073 -0.512 . . . . 1.0 112.101 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.474 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.45 -39.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.75 0.31 . . . . 1.0 110.883 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 p -178.22 70.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.721 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.92 -81.81 1.62 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.702 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.21 168.25 25.22 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 122.347 2.032 . . . . 1.0 112.379 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -96.78 159.83 14.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.58 164.65 15.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -53.79 -176.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.96 113.93 22.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.976 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 113.31 -26.51 10.27 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.743 -0.741 . . . . 1.0 112.629 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.487 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.5 m-30 -95.48 170.89 9.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 1.0 111.023 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.438 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 22.0 m-85 -136.49 -179.3 5.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.683 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.9 t -126.02 119.05 26.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.948 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.2 m -101.48 166.91 10.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.492 . . . . 1.0 110.42 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.1 m -149.08 53.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.895 0.379 . . . . 1.0 111.065 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.55 -163.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 1.0 110.568 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -60.19 83.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.839 0.352 . . . . 1.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -177.85 131.21 0.32 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.71 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.96 -26.53 59.12 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 1.0 112.518 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.67 125.44 48.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.417 -0.356 . . . . 1.0 111.211 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.44 146.02 43.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.203 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 24' ' ' SER . 0.1 OUTLIER -108.12 160.85 15.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 1.0 111.436 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.408 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.36 130.43 32.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.189 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -164.13 173.71 12.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.771 0.319 . . . . 1.0 111.013 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 21.6 t30 -43.07 164.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.582 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.438 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.69 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.043 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.8 t -111.1 111.66 22.92 Favored 'General case' 0 C--O 1.249 1.055 0 CA-C-O 118.259 -0.876 . . . . 1.0 110.895 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.76 0 O-C-N 123.479 0.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.786 0.327 . . . . 1.0 111.046 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -123.02 164.21 19.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.904 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m -85.45 149.5 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.231 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.16 -160.22 17.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 1.0 112.568 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.41 133.07 33.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.356 . . . . 1.0 110.959 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.06 -1.79 83.46 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.794 -0.717 . . . . 1.0 112.928 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.36 126.26 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.732 0.301 . . . . 1.0 111.144 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.439 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.11 121.49 17.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.792 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -59.02 142.37 51.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.762 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.44 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -46.85 142.38 3.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.422 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.013 -0.539 . . . . 1.0 112.19 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.29 -31.36 3.06 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 1.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -179.03 70.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.833 0.349 . . . . 1.0 110.851 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -92.95 -86.46 1.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.694 -0.765 . . . . 1.0 112.629 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.09 168.21 25.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.415 2.077 . . . . 1.0 112.378 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -99.28 173.1 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.81 165.3 12.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.911 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 84.4 m -53.95 -176.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.988 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.12 84.23 5.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.691 -0.686 . . . . 1.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.77 -25.8 2.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.672 -0.775 . . . . 1.0 112.674 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.469 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 4.1 m-30 -87.51 171.68 10.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.853 0.359 . . . . 1.0 110.98 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.436 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -138.54 178.97 6.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.0 110.589 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.6 t -129.76 114.83 16.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -102.7 173.92 6.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 1.0 110.959 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.5 m -145.13 66.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.868 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.46 -167.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.833 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -65.11 78.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.966 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.83 128.49 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.732 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -65.72 64.09 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.54 2.16 . . . . 1.0 112.334 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.79 94.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.796 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.6 m -57.21 134.68 56.13 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.946 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.31 153.65 20.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 1.0 111.005 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.3 128.42 54.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.448 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.48 172.23 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.032 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.469 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 35.0 t30 -46.74 169.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.0 111.447 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.436 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.6 p30 -69.72 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.077 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.64 -166.0 1.11 Allowed 'General case' 0 C--O 1.249 1.044 0 CA-C-O 118.209 -0.9 . . . . 1.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.785 0 O-C-N 123.578 0.549 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.864 0.364 . . . . 1.0 110.871 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.433 HG23 ' SG ' ' A' ' 17' ' ' CYS . 13.5 m -84.26 142.83 12.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.181 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.13 -160.36 1.63 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 1.0 112.581 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.63 128.22 36.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.881 0.372 . . . . 1.0 110.961 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 86.89 -7.87 78.38 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.922 -0.656 . . . . 1.0 112.84 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.52 126.4 29.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.618 0.247 . . . . 1.0 110.907 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.606 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 43.2 mtt85 -70.32 144.62 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 1.0 111.11 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -72.88 136.69 45.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.909 -0.587 . . . . 1.0 110.529 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.771 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -38.16 149.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.293 -0.412 . . . . 1.0 111.772 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.1 t 37.17 -91.31 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.01 -0.541 . . . . 1.0 112.163 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.76 -29.62 1.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.626 0.25 . . . . 1.0 111.156 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.8 p -179.52 71.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.782 0.325 . . . . 1.0 110.747 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.57 -84.57 1.8 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.761 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.771 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 39.7 Cg_endo -67.37 168.73 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.442 2.095 . . . . 1.0 112.479 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -101.37 -173.35 2.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.957 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' HG23 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -109.76 166.17 11.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.809 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 73.4 m -53.39 -176.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.055 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -80.04 85.61 5.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.16 -25.63 3.16 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.663 -0.78 . . . . 1.0 112.713 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -85.57 170.21 12.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.903 0.382 . . . . 1.0 110.986 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 17.1 m-85 -137.82 176.85 8.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 1.0 110.358 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 19.1 t -126.66 108.21 10.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 1.0 111.009 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.99 166.43 15.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.366 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.17 64.37 0.96 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.939 0.4 . . . . 1.0 111.253 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' MET . 0.7 OUTLIER -61.49 -162.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.403 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.14 75.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.439 -0.346 . . . . 1.0 110.925 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 178.72 149.62 0.42 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.625 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.34 -45.71 0.79 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.52 2.147 . . . . 1.0 112.415 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.606 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER -71.03 95.4 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.803 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.7 m -62.85 155.22 27.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.683 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -111.15 142.59 43.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.307 . . . . 1.0 110.962 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -119.84 123.73 44.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.203 179.484 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.96 174.19 15.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.156 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 6.3 t-20 -45.95 168.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.425 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.68 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.112 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.242 -0.885 . . . . 1.0 110.886 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.1 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.847 0.356 . . . . 1.0 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.5 m -86.89 154.27 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 1.0 111.258 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.51 -160.39 31.6 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.799 -0.715 . . . . 1.0 112.562 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.06 133.69 34.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 1.0 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.19 -1.11 81.96 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.89 -0.671 . . . . 1.0 112.813 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.39 124.57 24.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.73 0.3 . . . . 1.0 111.218 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.08 115.36 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 1.0 110.688 179.676 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.26 144.66 15.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.887 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.09 137.93 7.26 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.317 -0.401 . . . . 1.0 111.355 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.4 t 36.74 -90.83 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.988 -0.551 . . . . 1.0 112.177 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.432 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -123.3 -29.14 3.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.672 0.272 . . . . 1.0 111.172 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.23 71.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.876 0.369 . . . . 1.0 110.874 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.28 -88.49 1.41 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.774 -0.727 . . . . 1.0 112.589 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.561 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 74.0 Cg_endo -75.57 168.43 24.44 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.424 2.083 . . . . 1.0 112.377 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -97.37 175.5 6.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.78 165.35 12.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.852 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.7 m -53.63 -176.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.99 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.76 84.17 4.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.703 -0.681 . . . . 1.0 110.954 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.26 -28.16 2.71 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.667 -0.778 . . . . 1.0 112.597 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 6.0 m-30 -83.77 174.04 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 1.0 110.939 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.478 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 26.2 m-85 -142.84 179.94 6.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 1.0 110.484 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -131.4 119.41 21.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.837 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.08 164.81 11.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.039 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.4 m -132.39 60.94 1.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -56.19 -170.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.043 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -64.27 78.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.125 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.01 141.59 0.29 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.798 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.8 58.85 6.16 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.532 2.155 . . . . 1.0 112.415 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -178.85 89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.888 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.0 m -55.26 132.69 48.41 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.935 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -100.66 154.96 18.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.096 -179.534 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.74 126.61 52.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.304 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -153.88 172.42 17.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.481 -0.327 . . . . 1.0 111.039 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.465 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 3.4 t-20 -46.41 169.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.458 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 1.0 111.007 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.871 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.9 m -90.41 144.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.077 -0.51 . . . . 1.0 111.274 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.24 -160.17 2.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.854 -0.689 . . . . 1.0 112.811 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.97 128.83 35.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.837 0.351 . . . . 1.0 111.009 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 79.62 -1.57 77.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.84 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -70.55 136.11 49.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 1.0 111.238 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 22.1 mmt-85 -70.41 130.7 42.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.308 -0.405 . . . . 1.0 110.647 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.8 m -64.72 146.31 54.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.233 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.817 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.94 144.9 1.07 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.611 -0.268 . . . . 1.0 111.288 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t 37.75 -92.09 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.138 -0.483 . . . . 1.0 112.018 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.409 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.83 -28.46 2.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.613 0.244 . . . . 1.0 111.141 179.735 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p 175.48 73.24 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 1.0 110.769 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.82 -82.32 1.6 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.777 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.817 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.97 168.66 23.31 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.457 2.105 . . . . 1.0 112.421 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -96.73 -172.38 2.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.82 166.87 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 72.6 m -52.58 -176.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.112 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.9 84.2 2.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.78 -26.92 3.56 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.648 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -84.96 170.45 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.821 0.343 . . . . 1.0 110.854 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 14.8 m-85 -140.19 174.52 10.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.484 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 30.6 t -115.2 118.02 32.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.691 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.5 m -101.04 166.04 11.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.688 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.41 59.52 1.02 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.925 0.393 . . . . 1.0 111.107 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 28' ' ' MET . 2.8 ttm180 -59.35 -163.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.64 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -61.32 81.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 1.0 110.919 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 179.21 148.62 0.43 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.682 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -74.55 -22.35 15.97 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.576 2.184 . . . . 1.0 112.529 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -94.93 104.45 16.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.125 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.6 m -64.76 143.85 57.65 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.391 -0.368 . . . . 1.0 110.116 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -110.76 168.91 9.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.086 0.469 . . . . 1.0 111.682 -179.239 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -140.1 125.59 19.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.615 -0.721 . . . . 1.0 110.175 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -153.63 174.2 14.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.908 0.385 . . . . 1.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 5.2 t-20 -46.14 169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.518 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.489 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.3 p30 -69.59 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 1.0 111.103 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.256 -0.878 . . . . 1.0 110.875 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.86 0.362 . . . . 1.0 110.9 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 17' ' ' CYS . 19.4 m -92.66 142.94 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.506 . . . . 1.0 111.152 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.53 -160.25 7.31 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.787 -0.721 . . . . 1.0 112.782 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.05 137.12 33.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.815 0.34 . . . . 1.0 110.931 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 76.46 3.23 77.21 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.852 -0.689 . . . . 1.0 112.859 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.38 122.73 20.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.71 0.29 . . . . 1.0 111.109 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.607 ' HG2' ' CG ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -69.95 107.82 3.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.58 179.62 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.9 m -48.14 134.77 13.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.781 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.4 147.93 0.52 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.375 -0.375 . . . . 1.0 111.361 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.99 -89.56 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.02 -0.536 . . . . 1.0 112.055 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.464 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.04 -31.87 3.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.623 0.249 . . . . 1.0 111.088 179.724 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -178.25 70.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.909 0.385 . . . . 1.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.59 -89.86 1.76 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.883 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.549 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 52.6 Cg_exo -54.43 156.4 14.13 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.461 2.107 . . . . 1.0 112.54 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -101.75 146.37 27.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.656 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -68.56 161.63 27.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 1.0 111.005 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.53 -176.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.098 0.475 . . . . 1.0 110.992 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.73 85.27 2.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.861 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.56 -28.13 2.9 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.533 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.6 m-30 -85.41 173.79 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.862 0.363 . . . . 1.0 110.956 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 28.7 m-85 -145.08 179.11 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.995 -0.548 . . . . 1.0 110.376 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 38.7 t -120.46 116.33 25.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.582 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.91 162.94 13.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.053 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 39.2 m -150.02 69.9 1.03 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.735 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 ttm-85 -71.21 63.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.044 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m 48.97 81.6 0.05 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.254 -0.43 . . . . 1.0 111.256 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -156.48 169.54 10.35 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.905 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -92.05 25.52 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.123 2.548 . . . . 1.0 112.458 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.607 ' CG ' ' HG2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -174.55 93.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.588 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.4 m -56.02 153.04 9.41 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.005 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 3.2 ptt85 -115.77 161.4 18.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.975 0.417 . . . . 1.0 111.216 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 126.43 44.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.0 110.428 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.2 173.4 15.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.94 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.486 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 2.8 t-20 -45.85 168.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 1.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.475 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.2 p30 -69.7 -76.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.004 -0.544 . . . . 1.0 111.058 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.4 t . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.236 -0.888 . . . . 1.0 110.907 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.6 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.858 0.361 . . . . 1.0 110.962 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.6 m -84.74 148.46 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 1.0 111.217 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.59 -160.22 4.13 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.802 -0.714 . . . . 1.0 112.623 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.6 136.33 33.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.862 0.363 . . . . 1.0 110.931 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 74.47 5.59 73.37 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.907 -0.663 . . . . 1.0 112.83 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.5 120.68 16.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.702 0.287 . . . . 1.0 111.089 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HD2' ' CE2' ' A' ' 30' ' ' TYR . 3.4 ptp180 -70.27 120.82 16.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.362 . . . . 1.0 110.642 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.8 m -56.17 142.4 37.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.857 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.666 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -48.92 147.48 2.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.339 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 33.93 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.995 -0.548 . . . . 1.0 112.166 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -30.32 2.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.734 0.302 . . . . 1.0 111.136 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -178.58 70.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.881 0.372 . . . . 1.0 110.756 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.76 -85.66 1.72 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.718 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.666 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 55.7 Cg_endo -70.63 168.21 23.33 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.449 2.099 . . . . 1.0 112.39 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -99.32 -176.65 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.954 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 165.47 12.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.7 m -53.89 -175.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.038 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.26 88.52 7.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.988 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.21 -25.0 3.2 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.67 -0.776 . . . . 1.0 112.806 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -87.48 170.08 11.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.872 0.368 . . . . 1.0 111.055 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.454 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.7 m-85 -137.67 174.33 10.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.397 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 40.9 t -127.41 109.81 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 1.0 110.999 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -96.57 159.5 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.776 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.1 m -129.87 59.42 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 1.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.1 -169.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.079 -0.509 . . . . 1.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -63.23 82.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 1.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.52 144.83 0.41 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.843 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.6 54.93 5.42 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.631 2.221 . . . . 1.0 112.476 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE2' ' HD2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER 176.55 97.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 1.0 110.782 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.3 m -54.94 140.61 36.68 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.336 -0.393 . . . . 1.0 110.96 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.43 142.68 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.983 -179.687 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -110.85 124.4 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 1.0 110.477 179.56 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -149.19 171.52 16.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.028 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.501 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 5.0 t-20 -51.26 170.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.206 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.454 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.63 -77.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 1.0 111.066 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 1.0 110.872 179.992 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.887 0.375 . . . . 1.0 110.917 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.4 m -91.85 143.42 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 1.0 111.386 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.19 -160.32 0.82 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.766 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 21' ' ' TYR . 1.2 m-20 -88.33 128.62 35.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.876 0.369 . . . . 1.0 111.076 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 84.89 -7.59 73.79 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.92 -0.657 . . . . 1.0 112.892 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -70.87 131.0 43.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.636 0.255 . . . . 1.0 111.145 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.814 ' CD ' ' CG ' ' A' ' 30' ' ' TYR . 45.3 mtm-85 -70.11 143.42 52.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.73 0.3 . . . . 1.0 110.582 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.7 m -73.54 151.61 40.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.414 -0.357 . . . . 1.0 110.231 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.17 148.05 0.65 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.578 -0.283 . . . . 1.0 111.385 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 36.26 -89.57 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.081 -0.508 . . . . 1.0 112.061 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.443 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.9 -35.17 2.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.74 0.305 . . . . 1.0 110.873 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p 179.63 70.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 1.0 110.722 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -96.57 -82.35 1.62 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.814 -0.708 . . . . 1.0 112.669 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.742 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 56.2 Cg_endo -70.5 166.1 29.63 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.439 2.093 . . . . 1.0 112.349 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.69 -174.48 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.9 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 166.88 10.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.84 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 97.0 m -52.6 -176.66 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 1.0 111.127 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.58 83.31 2.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.581 -0.736 . . . . 1.0 110.882 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 134.66 -25.47 3.41 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -87.32 170.57 11.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.844 0.354 . . . . 1.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.7 m-85 -138.64 177.68 7.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.615 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 12.9 t -124.43 111.02 15.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.98 -0.555 . . . . 1.0 110.881 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.0 172.04 7.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.704 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 m -147.27 68.55 1.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.344 -0.389 . . . . 1.0 110.773 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -58.15 -171.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.075 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -64.85 78.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER 175.31 128.52 0.13 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.687 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.39 73.65 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 1.0 112.349 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.814 ' CG ' ' CD ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 175.88 92.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.795 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.8 m -60.53 132.11 52.88 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.551 -0.295 . . . . 1.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -101.53 153.24 19.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.76 0.314 . . . . 1.0 111.138 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -122.3 123.61 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.308 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.77 174.42 15.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.332 -0.395 . . . . 1.0 111.185 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.502 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 6.7 t-20 -44.55 167.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.656 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.65 -77.34 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.015 -0.539 . . . . 1.0 111.11 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.18 -0.914 . . . . 1.0 110.94 -179.95 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.2 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.882 0.372 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.7 m -115.94 143.41 25.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.905 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.408 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 170.54 -158.79 30.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.441 -0.885 . . . . 1.0 112.895 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 55.26 58.84 4.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.387 . . . . 1.0 111.156 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.65 3.71 73.5 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.928 -0.654 . . . . 1.0 112.977 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.52 131.05 43.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 1.0 111.213 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.39 124.28 23.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.689 179.509 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -60.19 137.95 58.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.563 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.716 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.46 146.71 1.96 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.404 . . . . 1.0 111.302 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t 34.78 -88.95 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.089 -0.505 . . . . 1.0 112.048 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.47 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.92 -36.08 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.745 0.307 . . . . 1.0 110.931 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 p -179.31 71.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 1.0 110.72 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -101.02 -85.69 1.88 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.858 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.716 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 31.6 Cg_exo -58.07 165.54 6.78 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.365 2.044 . . . . 1.0 112.392 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -100.12 146.85 26.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.651 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.8 158.95 30.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.893 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.9 m -54.14 -176.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.077 0.465 . . . . 1.0 110.961 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -85.45 107.21 17.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.027 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.51 -26.31 7.36 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.739 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.512 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.65 170.18 9.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 1.0 110.938 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.47 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.2 m-85 -136.76 178.79 6.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.684 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -123.31 118.69 28.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.825 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.06 129.32 46.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.846 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.9 m -106.34 47.48 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 1.0 110.821 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -57.91 -166.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.942 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -62.72 81.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 1.0 111.014 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.2 126.38 0.25 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 1.0 110.734 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.95 -27.31 44.2 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.416 2.077 . . . . 1.0 112.281 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.02 95.42 5.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.951 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.5 m -55.74 149.32 14.65 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.836 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 16.6 mtt85 -107.03 160.78 15.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.953 0.406 . . . . 1.0 111.136 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -131.6 127.78 37.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.196 179.646 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.29 174.47 14.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.741 0.305 . . . . 1.0 111.127 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.512 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.3 t-20 -43.07 165.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.57 -76.41 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.971 -0.559 . . . . 1.0 111.109 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.254 -0.879 . . . . 1.0 110.906 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.894 0.378 . . . . 1.0 110.885 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.11 148.63 4.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.296 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.73 -160.21 19.8 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.807 -0.711 . . . . 1.0 112.645 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -81.6 138.44 35.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.364 . . . . 1.0 111.031 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.42 9.93 59.09 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.956 -0.64 . . . . 1.0 112.814 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.47 127.64 33.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.682 0.277 . . . . 1.0 111.306 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.16 111.37 5.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.387 -0.37 . . . . 1.0 110.516 179.372 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 24.6 m -52.75 138.95 27.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.854 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.826 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.78 147.15 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.466 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 33.84 -89.2 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.121 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.46 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.83 -34.73 1.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.677 0.275 . . . . 1.0 110.96 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 p -177.7 70.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.404 . . . . 1.0 110.844 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.01 -81.3 1.58 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.751 -0.738 . . . . 1.0 112.749 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.826 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 51.5 Cg_endo -69.41 168.19 21.81 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.447 2.098 . . . . 1.0 112.46 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -97.4 -168.3 1.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.75 166.38 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.982 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 88.9 m -53.16 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.046 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -81.96 83.85 7.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.71 -0.677 . . . . 1.0 110.866 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.76 -26.61 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.613 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CE1' ' ND2' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.05 170.16 10.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 1.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.473 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.5 m-85 -138.57 173.82 11.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.402 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.79 113.83 26.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.291 -0.413 . . . . 1.0 110.772 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.1 164.46 12.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.694 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.4 m -150.9 65.73 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.034 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -66.72 -163.95 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.66 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -63.44 80.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 1.0 110.911 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.37 155.04 5.98 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.824 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.55 -37.2 3.27 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.206 . . . . 1.0 112.415 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.17 122.82 40.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.047 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 36.7 m -72.01 162.65 29.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.391 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.77 172.47 11.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.087 0.47 . . . . 1.0 111.517 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.414 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -135.3 128.43 31.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.297 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -147.74 171.18 16.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.767 0.318 . . . . 1.0 111.065 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.514 ' ND2' ' CE1' ' A' ' 21' ' ' TYR . 3.9 t-20 -50.5 170.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 1.0 111.257 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.473 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.65 -76.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.062 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.2 -0.905 . . . . 1.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.841 0.353 . . . . 1.0 110.9 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.4 m -91.94 144.14 9.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.084 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.71 -160.32 13.45 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.766 -0.731 . . . . 1.0 112.663 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.93 138.8 33.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.79 0.328 . . . . 1.0 110.963 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.68 3.07 71.73 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.863 -0.684 . . . . 1.0 112.933 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.35 120.12 15.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.725 0.297 . . . . 1.0 111.112 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HG2' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.1 106.57 3.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.599 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 96.3 m -48.06 133.96 14.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.314 -0.403 . . . . 1.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.452 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -42.84 144.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.87 -90.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.931 -0.577 . . . . 1.0 112.117 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.58 -25.85 3.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.633 0.254 . . . . 1.0 111.238 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 p 178.92 71.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.856 0.36 . . . . 1.0 110.905 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.01 -95.72 1.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.631 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.452 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.9 Cg_exo -53.18 164.3 1.88 Allowed 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.311 2.008 . . . . 1.0 112.444 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -107.08 149.41 27.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.439 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -71.54 160.27 33.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.86 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.74 -176.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.978 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -77.02 84.25 3.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.911 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 139.27 -27.07 2.66 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.754 -0.736 . . . . 1.0 112.607 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.476 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.2 m-30 -88.07 173.3 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.847 0.356 . . . . 1.0 110.943 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.48 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 24.5 m-85 -141.68 179.2 6.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.419 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.0 t -125.83 114.17 18.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.811 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.89 154.01 17.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 1.0 110.948 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.15 57.53 1.39 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.874 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -175.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.9 82.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.958 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.78 145.15 0.46 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.812 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -79.69 54.74 5.33 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.691 2.261 . . . . 1.0 112.46 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CD1' ' HG2' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.85 89.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.777 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.8 m -55.03 144.41 23.59 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.918 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -111.24 158.01 19.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.953 0.406 . . . . 1.0 111.031 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.93 127.64 54.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.604 179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -152.54 171.66 17.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.855 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.476 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.2 t-20 -47.09 170.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 1.0 111.361 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.48 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.6 -76.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.088 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.249 -0.882 . . . . 1.0 110.885 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.918 0.389 . . . . 1.0 110.946 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -132.77 143.44 39.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.971 -0.558 . . . . 1.0 110.935 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 178.34 -158.06 22.46 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.438 -0.887 . . . . 1.0 113.001 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 56.55 66.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.909 0.385 . . . . 1.0 111.147 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.27 -2.73 80.63 Favored Glycine 0 CA--C 1.52 0.347 0 C-N-CA 120.948 -0.644 . . . . 1.0 112.912 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.57 119.09 14.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.724 0.262 . . . . 1.0 111.182 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 2.7 ptp180 -70.26 119.19 14.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.946 0.403 . . . . 1.0 110.623 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.69 140.41 23.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.035 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -46.59 147.89 1.12 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.254 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.939 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.457 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.32 -24.41 3.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.635 0.255 . . . . 1.0 111.1 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 p 175.02 73.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.824 0.345 . . . . 1.0 110.708 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.73 -94.12 2.02 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.753 -0.737 . . . . 1.0 112.902 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 44.0 Cg_exo -55.98 161.21 8.86 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.357 2.038 . . . . 1.0 112.466 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -96.19 152.58 18.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.678 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.14 156.85 28.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 1.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 74.4 m -53.76 -176.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.105 0.479 . . . . 1.0 110.959 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.16 93.96 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.782 -0.645 . . . . 1.0 111.036 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.45 3.52 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.656 -0.783 . . . . 1.0 112.778 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.511 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.15 170.1 9.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 1.0 111.05 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.3 m-85 -137.3 179.12 6.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.372 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 t -126.24 113.76 17.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.455 . . . . 1.0 111.004 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.45 139.43 32.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.529 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.5 m -116.19 52.38 0.92 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.962 0.411 . . . . 1.0 111.006 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.8 ttm180 -58.46 -163.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.769 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.57 81.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.487 -0.324 . . . . 1.0 110.978 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 178.96 147.8 0.4 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.726 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.79 -34.67 6.56 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.548 2.165 . . . . 1.0 112.252 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.449 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -97.01 96.45 8.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.835 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.4 m -55.45 151.55 10.06 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.492 -0.322 . . . . 1.0 110.731 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -108.58 142.39 39.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.884 0.373 . . . . 1.0 111.115 -179.546 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.461 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -114.22 124.02 51.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.122 179.453 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.31 174.05 15.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.157 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.511 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 6.9 t-20 -43.2 165.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.462 . . . . 1.0 111.675 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.56 -77.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.091 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.231 -0.89 . . . . 1.0 110.911 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.6 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.947 0.403 . . . . 1.0 110.946 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.88 149.16 26.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.894 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 167.59 -158.4 31.24 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.37 -0.919 . . . . 1.0 112.905 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 56.13 58.74 4.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.385 . . . . 1.0 111.216 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.23 -0.52 83.85 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.824 -0.703 . . . . 1.0 113.011 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.26 129.32 39.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.778 0.323 . . . . 1.0 111.264 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.49 122.9 20.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 1.0 110.585 179.541 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 7.5 m -55.54 141.22 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.496 -0.32 . . . . 1.0 110.614 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.658 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -49.24 145.16 4.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.363 -0.38 . . . . 1.0 111.216 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.85 -89.0 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.042 -0.526 . . . . 1.0 112.053 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.471 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -35.83 2.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.731 0.301 . . . . 1.0 111.01 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.7 p -179.57 71.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.889 0.376 . . . . 1.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.29 -87.48 1.93 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.739 -0.744 . . . . 1.0 112.735 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.658 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 38.6 Cg_exo -59.77 168.26 5.82 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.401 2.068 . . . . 1.0 112.36 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -105.12 147.11 28.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.634 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.64 158.06 36.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.863 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.7 m -53.84 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.107 0.48 . . . . 1.0 111.079 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -82.6 105.06 13.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.974 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.08 -25.94 6.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.652 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.02 170.53 9.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.788 0.328 . . . . 1.0 110.959 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -136.48 179.85 6.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.696 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.5 t -126.31 114.83 18.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -99.02 168.84 9.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.428 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.3 m -148.71 66.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.912 0.387 . . . . 1.0 111.189 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -162.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.55 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.8 m -67.21 66.95 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 5.2 mmt -159.98 135.46 5.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.729 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.17 -29.52 75.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.398 2.065 . . . . 1.0 112.432 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.21 119.72 36.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 1.0 111.126 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.3 m -71.84 151.01 43.77 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.291 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -110.44 154.91 22.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.858 0.361 . . . . 1.0 111.267 -179.282 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.441 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -131.1 127.54 38.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.068 -0.514 . . . . 1.0 110.1 179.406 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -162.29 173.78 13.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.747 0.308 . . . . 1.0 111.154 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.508 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 5.7 t-20 -43.16 165.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.709 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.468 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.58 -76.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.096 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 1.0 110.926 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.85 0.357 . . . . 1.0 110.943 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -81.98 147.29 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.267 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.15 -160.11 7.98 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.85 -0.69 . . . . 1.0 112.623 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.98 138.76 33.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.863 0.363 . . . . 1.0 110.995 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.92 12.75 58.07 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.864 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.4 127.77 33.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 1.0 111.09 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.2 111.22 5.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.623 179.554 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' CE1' ' A' ' 30' ' ' TYR . 70.5 m -52.87 134.44 37.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.744 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.749 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -43.68 143.88 0.92 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.575 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.17 -90.13 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.945 -0.57 . . . . 1.0 112.151 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.445 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.39 -30.46 1.91 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.663 0.268 . . . . 1.0 111.262 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -178.71 70.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.819 0.342 . . . . 1.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.65 -84.0 1.75 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.755 -0.736 . . . . 1.0 112.743 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.749 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.6 Cg_endo -71.61 168.56 23.3 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.472 2.115 . . . . 1.0 112.443 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -97.51 -170.8 2.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.964 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.464 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.1 OUTLIER -115.55 165.75 12.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.883 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.6 m -53.51 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 1.0 111.059 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.84 84.22 7.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.877 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.01 -26.6 2.6 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.703 -0.761 . . . . 1.0 112.594 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.524 ' CE1' ' ND2' ' A' ' 35' ' ' ASN . 2.7 m-30 -90.38 169.82 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.34 . . . . 1.0 110.939 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.2 m-85 -137.2 174.17 10.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.432 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 51.8 t -113.29 113.21 24.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.312 -0.403 . . . . 1.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 t -94.16 167.47 11.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 1.0 110.665 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 62.8 m -150.62 63.86 0.94 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.956 0.408 . . . . 1.0 111.085 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -63.31 -163.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.604 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.17 81.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 1.0 110.871 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.28 149.69 0.68 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.848 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.95 -36.68 7.29 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 1.0 112.371 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.451 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER -90.19 112.21 23.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.932 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.01 162.16 22.7 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.555 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -126.29 170.22 12.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.009 0.433 . . . . 1.0 111.387 -179.634 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.06 129.53 34.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.796 -0.638 . . . . 1.0 110.409 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -151.13 169.97 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 1.0 110.976 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.524 ' ND2' ' CE1' ' A' ' 21' ' ' TYR . 4.1 t-20 -49.09 170.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 1.0 111.276 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.67 -76.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.999 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.4 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.174 -0.917 . . . . 1.0 110.877 -179.98 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HB2' ' N ' ' A' ' 18' ' ' CYS . 27.9 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.945 0.402 . . . . 1.0 110.983 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.51 HG12 ' CG ' ' A' ' 7' ' ' GLN . 0.1 OUTLIER -93.25 164.76 2.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.096 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.71 -160.71 32.45 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.859 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -88.19 132.48 34.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.891 0.377 . . . . 1.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.39 6.96 59.59 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.961 -0.637 . . . . 1.0 112.826 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.51 ' CG ' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.97 129.48 39.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.584 0.231 . . . . 1.0 111.23 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.37 112.22 6.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.969 0.414 . . . . 1.0 110.562 179.507 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 19.2 m -50.51 139.84 15.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.312 -0.404 . . . . 1.0 110.856 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.31 145.84 0.76 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.404 -0.362 . . . . 1.0 111.314 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 35.49 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.729 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.462 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -142.48 5.03 1.6 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.473 0.175 . . . . 1.0 111.473 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 12' ' ' TRP . 1.7 p 163.31 77.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.717 0.294 . . . . 1.0 110.558 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.66 -100.06 2.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.602 -0.809 . . . . 1.0 113.063 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.455 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.5 Cg_exo -53.15 165.95 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.426 2.084 . . . . 1.0 112.705 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -108.94 149.39 29.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 1.0 110.618 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.09 157.35 38.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 1.0 111.026 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 21' ' ' TYR . 76.1 m -62.45 -176.62 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.914 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.43 94.04 2.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.98 -9.24 7.12 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.739 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 2.0 m-85 -110.62 170.75 7.89 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.749 0.309 . . . . 1.0 110.775 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 36' ' ' ASN . 18.5 m-85 -142.44 173.64 11.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.266 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.4 t -117.35 114.43 23.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.25 -0.432 . . . . 1.0 111.188 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -95.77 169.47 9.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.37 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 85.3 m -151.32 70.29 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 1.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -62.12 -164.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.635 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -69.5 65.06 0.18 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.903 0.382 . . . . 1.0 111.159 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 9.1 mmt -155.83 157.12 31.3 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.788 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.48 -45.52 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.514 2.142 . . . . 1.0 112.378 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.54 107.57 16.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 1.0 110.857 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 9' ' ' CYS . 35.6 m -61.21 167.6 3.03 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.253 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -128.21 164.25 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.085 0.469 . . . . 1.0 111.795 -179.413 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.443 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.21 124.96 23.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.189 179.588 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -145.21 172.68 12.78 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.831 0.348 . . . . 1.0 111.096 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.451 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 3.6 t-20 -50.97 171.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.923 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HA ' ' CD2' ' A' ' 22' ' ' TYR . 1.4 p30 -69.9 -77.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.985 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.194 -0.908 . . . . 1.0 110.887 -179.938 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.9 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.886 0.374 . . . . 1.0 110.93 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.3 m -92.63 145.27 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 1.0 111.129 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.05 -160.95 8.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.811 -0.709 . . . . 1.0 112.715 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.71 135.0 33.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 1.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.01 0.87 77.6 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 1.0 112.772 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.45 128.39 36.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.726 0.298 . . . . 1.0 111.229 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.32 115.5 9.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 1.0 110.556 179.501 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 64.1 m -55.77 135.65 51.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.436 -0.347 . . . . 1.0 110.561 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.55 146.44 0.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.543 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.38 -90.03 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.042 -0.527 . . . . 1.0 111.986 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.65 -23.75 3.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.599 0.238 . . . . 1.0 111.305 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p 177.36 72.54 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.885 0.374 . . . . 1.0 110.764 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.19 -94.24 2.06 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.822 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.534 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 51.3 Cg_exo -53.48 165.1 1.73 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.353 2.035 . . . . 1.0 112.574 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -108.49 149.44 28.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.653 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 157.22 38.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -57.28 -176.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.088 0.47 . . . . 1.0 110.957 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -75.68 87.47 2.74 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 135.75 -27.31 3.08 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.524 ' CE1' ' ND2' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.33 170.45 9.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.723 0.297 . . . . 1.0 110.783 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.491 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.1 m-85 -139.71 173.59 11.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.572 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.2 t -111.43 112.99 25.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.687 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.94 166.03 12.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.695 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.5 m -151.22 66.42 0.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.985 0.422 . . . . 1.0 110.993 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -68.17 -163.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.663 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -63.83 79.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.1 141.07 0.42 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.778 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.02 -62.68 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.469 2.112 . . . . 1.0 112.294 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.88 115.02 6.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.999 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.1 m -69.6 169.32 12.93 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.326 -0.397 . . . . 1.0 110.329 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.1 170.02 14.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.07 0.462 . . . . 1.0 111.467 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.419 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -139.43 126.89 21.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.394 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.27 173.34 15.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 1.0 111.054 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.524 ' ND2' ' CE1' ' A' ' 21' ' ' TYR . 4.3 t-20 -47.51 170.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.406 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.491 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.2 p30 -69.54 -76.43 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 1.0 111.042 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.925 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.792 0.33 . . . . 1.0 110.904 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 m -111.83 162.96 9.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.058 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.16 -160.32 31.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.645 -0.788 . . . . 1.0 112.595 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 53.13 63.75 2.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.883 0.373 . . . . 1.0 111.074 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.39 2.02 83.08 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.901 -0.666 . . . . 1.0 112.871 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -70.34 123.2 21.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.736 0.303 . . . . 1.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.18 122.78 20.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.814 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 79.8 m -59.62 142.11 53.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.521 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.71 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.18 140.6 3.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.371 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.21 -90.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.005 -0.543 . . . . 1.0 112.098 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.81 -29.74 2.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.697 0.284 . . . . 1.0 111.129 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p 178.23 72.14 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 1.0 110.771 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.45 -91.58 1.57 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.701 -0.762 . . . . 1.0 112.74 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.71 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 71.9 Cg_endo -75.19 168.53 24.5 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.471 2.114 . . . . 1.0 112.466 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -81.62 -170.49 2.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.38 165.79 20.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.505 . . . . 1.0 110.796 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.8 m -53.68 -176.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.99 -0.55 . . . . 1.0 111.045 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -93.59 124.75 37.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.749 -0.659 . . . . 1.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.85 -27.69 14.11 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.709 -0.757 . . . . 1.0 112.623 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.67 170.32 9.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.838 0.351 . . . . 1.0 110.933 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 16.3 m-85 -135.82 177.19 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.053 -0.522 . . . . 1.0 110.411 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.7 t -127.67 110.69 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.973 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -99.2 170.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.68 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.6 m -142.17 65.75 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -60.08 -168.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.91 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 m -64.99 78.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.034 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.432 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER 179.71 129.74 0.24 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.725 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 18.9 Cg_exo -66.26 63.76 0.49 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.527 2.152 . . . . 1.0 112.307 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 177.13 94.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.861 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -56.97 136.36 56.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.782 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.97 142.64 34.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.94 0.4 . . . . 1.0 111.095 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -109.11 124.97 51.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.422 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -153.04 170.83 19.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.446 -0.343 . . . . 1.0 111.014 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.5 t-20 -46.39 168.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.332 -0.394 . . . . 1.0 111.454 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.72 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 1.0 111.077 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.272 -0.87 . . . . 1.0 110.896 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.897 0.379 . . . . 1.0 110.969 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.469 HG12 ' OE1' ' A' ' 7' ' ' GLN . 6.1 m -116.62 163.87 13.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 1.0 111.037 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.17 -160.25 31.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.676 -0.773 . . . . 1.0 112.67 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 t70 53.59 66.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 1.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.05 -2.09 82.31 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.963 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.469 ' OE1' HG12 ' A' ' 3' ' ' VAL . 0.4 OUTLIER -70.59 116.62 11.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.652 0.263 . . . . 1.0 111.117 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.3 118.51 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.888 0.375 . . . . 1.0 110.879 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 88.0 m -51.23 138.92 19.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.93 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.729 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.46 146.04 0.76 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.482 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.4 t 34.8 -90.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.963 -0.562 . . . . 1.0 112.032 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.456 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.88 -30.58 2.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 1.0 111.034 179.764 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.1 p -179.44 71.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.858 0.361 . . . . 1.0 110.641 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.52 -91.01 1.75 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.757 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.729 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 58.9 Cg_endo -72.17 168.25 24.6 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.442 2.094 . . . . 1.0 112.478 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -87.26 -175.06 5.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.84 164.92 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.868 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.8 m -54.1 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.01 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -93.5 118.46 31.37 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.668 -0.697 . . . . 1.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 115.16 -27.43 8.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.708 -0.758 . . . . 1.0 112.636 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.506 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.51 170.2 9.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.897 0.379 . . . . 1.0 110.892 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 15.0 m-85 -135.77 176.24 8.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.239 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 t -127.65 109.19 11.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.34 151.07 21.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 1.0 110.448 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.51 56.56 1.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 1.0 111.088 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -59.48 -175.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.839 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -61.28 85.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 1.0 111.006 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.35 145.12 0.43 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.862 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.02 54.34 5.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.67 2.247 . . . . 1.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 174.41 92.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.64 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.75 144.46 14.19 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.454 -0.339 . . . . 1.0 110.764 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.58 141.97 35.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.35 . . . . 1.0 111.023 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -114.09 122.22 46.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.219 179.431 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.66 172.02 16.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.291 -0.413 . . . . 1.0 111.125 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.506 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.5 t-20 -46.0 168.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.455 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.59 -76.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.085 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 1.0 110.887 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.801 0.334 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.9 m -112.97 163.04 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.947 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.97 -160.02 30.06 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.573 -0.822 . . . . 1.0 112.738 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.58 52.5 12.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.872 0.368 . . . . 1.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.11 -0.16 83.62 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.858 -0.686 . . . . 1.0 112.949 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.29 126.46 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.74 0.305 . . . . 1.0 111.02 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 1.5 mpp_? -70.15 124.85 25.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.37 . . . . 1.0 110.835 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.9 m -57.97 138.97 55.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.268 -0.423 . . . . 1.0 110.605 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.875 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.38 143.62 1.73 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.393 . . . . 1.0 111.449 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.3 t 35.43 -89.31 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.985 -0.552 . . . . 1.0 112.128 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.461 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.15 -38.76 1.59 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.718 0.294 . . . . 1.0 110.802 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.3 p -177.12 69.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 1.0 110.787 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.06 -81.26 1.59 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.728 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.875 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 61.4 Cg_endo -73.39 167.76 26.47 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.451 2.1 . . . . 1.0 112.44 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -89.05 -171.64 3.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.03 164.39 20.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.815 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.8 m -54.16 -176.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.157 0.503 . . . . 1.0 110.932 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -90.88 122.54 33.67 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 1.0 111.083 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.98 -26.3 17.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 1.0 112.661 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.4 m-30 -95.66 170.72 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.825 0.345 . . . . 1.0 111.059 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.465 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.5 m-85 -135.85 178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.595 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.4 t -127.53 105.94 8.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.974 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.48 170.27 10.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.704 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 m -147.18 68.27 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.318 -0.401 . . . . 1.0 110.881 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm-85 -62.04 -171.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.95 80.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.991 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.09 144.04 0.49 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.859 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.16 58.21 6.12 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.619 2.212 . . . . 1.0 112.449 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.78 97.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.844 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -58.98 147.17 35.43 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.706 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 1.0 111.087 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.02 125.55 54.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.327 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 173.23 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.134 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.5 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 39.5 t30 -45.0 167.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.501 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.465 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.72 -76.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.045 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.22 -0.895 . . . . 1.0 110.928 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.847 0.356 . . . . 1.0 110.941 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.417 HG12 ' NE2' ' A' ' 7' ' ' GLN . 6.0 m -99.46 143.39 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 1.0 110.854 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.29 174.05 44.22 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.45 -0.881 . . . . 1.0 113.032 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.27 75.21 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.874 0.369 . . . . 1.0 111.349 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 72.07 6.4 64.3 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.006 -0.616 . . . . 1.0 113.211 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' NE2' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.54 118.95 13.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.934 0.367 . . . . 1.0 111.215 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.18 109.52 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.661 179.581 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.73 139.72 12.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.383 -0.371 . . . . 1.0 110.902 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.774 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.51 141.29 2.78 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.59 -89.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.973 -0.558 . . . . 1.0 112.201 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.454 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.23 -36.42 2.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.722 0.296 . . . . 1.0 110.983 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -178.67 70.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.11 -91.05 1.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 1.0 112.647 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.774 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.58 168.33 23.93 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.467 2.111 . . . . 1.0 112.397 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -78.12 -175.32 4.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 t -117.67 165.25 13.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 66.1 m -53.62 -176.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 1.0 111.056 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -94.44 118.03 31.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.057 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.16 -29.47 9.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.583 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.52 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.3 m-30 -97.33 169.81 9.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.777 0.322 . . . . 1.0 110.831 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.2 m-85 -133.39 175.31 9.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 1.0 110.396 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.3 t -119.12 112.68 19.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.001 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -95.93 151.19 19.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.811 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.0 m -127.08 57.73 1.46 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 1.0 110.962 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -61.63 -171.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.834 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -62.81 83.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.056 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.93 143.53 0.49 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.806 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.77 53.42 4.77 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.709 2.273 . . . . 1.0 112.576 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER 177.33 90.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 1.0 110.82 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.2 m -55.26 142.76 30.43 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.889 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -112.77 153.79 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.947 0.403 . . . . 1.0 111.134 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -112.31 125.22 53.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.556 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -146.37 166.46 26.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.52 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 3.9 t-20 -45.69 168.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 1.0 111.486 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.71 -77.02 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 1.0 111.073 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.29 -0.862 . . . . 1.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.865 0.364 . . . . 1.0 110.917 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.1 m -121.92 162.51 21.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.071 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 161.52 -159.12 30.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.598 -0.811 . . . . 1.0 112.851 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 t70 55.23 60.43 3.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 1.0 111.241 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.1 -0.58 83.13 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.826 -0.702 . . . . 1.0 112.955 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -70.25 133.61 47.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 1.0 111.25 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.43 124.7 24.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.687 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -58.19 144.56 40.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.542 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.863 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -51.81 141.23 17.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.49 -0.323 . . . . 1.0 111.048 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 35.42 -88.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.073 -0.512 . . . . 1.0 112.101 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.474 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.45 -39.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.75 0.31 . . . . 1.0 110.883 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 p -178.22 70.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.721 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.92 -81.81 1.62 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.702 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.863 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 60.6 Cg_endo -73.21 168.25 25.22 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 122.347 2.032 . . . . 1.0 112.379 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -96.78 159.83 14.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.58 164.65 15.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -53.79 -176.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.96 113.93 22.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.976 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 113.31 -26.51 10.27 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.743 -0.741 . . . . 1.0 112.629 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.5 m-30 -95.48 170.89 9.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 1.0 111.023 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 22.0 m-85 -136.49 -179.3 5.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.683 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.9 t -126.02 119.05 26.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.948 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.2 m -101.48 166.91 10.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.492 . . . . 1.0 110.42 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.1 m -149.08 53.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.895 0.379 . . . . 1.0 111.065 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.55 -163.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 1.0 110.568 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -60.19 83.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.839 0.352 . . . . 1.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.417 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.1 OUTLIER -177.85 131.21 0.32 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.71 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 48.7 Cg_exo -55.96 -26.53 59.12 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 1.0 112.518 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.67 125.44 48.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.417 -0.356 . . . . 1.0 111.211 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.44 146.02 43.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.203 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 24' ' ' SER . 0.1 OUTLIER -108.12 160.85 15.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 1.0 111.436 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.408 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.36 130.43 32.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.189 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -164.13 173.71 12.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.771 0.319 . . . . 1.0 111.013 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.494 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 7.3 t-20 -43.07 164.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.582 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.69 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.043 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.259 -0.876 . . . . 1.0 110.895 -179.952 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.875 0.369 . . . . 1.0 110.904 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -85.45 149.5 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.231 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.16 -160.22 17.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 1.0 112.568 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.41 133.07 33.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.356 . . . . 1.0 110.959 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.06 -1.79 83.46 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.794 -0.717 . . . . 1.0 112.928 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.36 126.26 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.732 0.301 . . . . 1.0 111.144 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.11 121.49 17.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.792 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -59.02 142.37 51.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.762 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.645 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.85 142.38 3.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.422 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.013 -0.539 . . . . 1.0 112.19 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.29 -31.36 3.06 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 1.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -179.03 70.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.833 0.349 . . . . 1.0 110.851 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -92.95 -86.46 1.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.694 -0.765 . . . . 1.0 112.629 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.645 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 63.4 Cg_endo -74.09 168.21 25.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.415 2.077 . . . . 1.0 112.378 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -99.28 173.1 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -94.81 165.3 12.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.911 179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 84.4 m -53.95 -176.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.988 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.12 84.23 5.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.691 -0.686 . . . . 1.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.77 -25.8 2.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.672 -0.775 . . . . 1.0 112.674 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 4.1 m-30 -87.51 171.68 10.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.853 0.359 . . . . 1.0 110.98 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.456 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -138.54 178.97 6.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.0 110.589 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.6 t -129.76 114.83 16.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -102.7 173.92 6.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 1.0 110.959 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.5 m -145.13 66.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.868 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.46 -167.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.833 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -65.11 78.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.966 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.47 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER -179.83 128.49 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.732 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 20.2 Cg_exo -65.72 64.09 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.54 2.16 . . . . 1.0 112.334 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.441 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.79 94.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.796 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.6 m -57.21 134.68 56.13 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.946 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -103.31 153.65 20.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 1.0 111.005 -179.621 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.3 128.42 54.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.448 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.48 172.23 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.032 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.475 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.8 t-20 -46.74 169.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.0 111.447 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.6 p30 -69.72 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.077 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.209 -0.9 . . . . 1.0 110.91 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.82 0.343 . . . . 1.0 111.011 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p -112.63 164.01 13.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.433 HG23 ' SG ' ' A' ' 17' ' ' CYS . 13.5 m -84.26 142.83 12.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.181 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.13 -160.36 1.63 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 1.0 112.581 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.63 128.22 36.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.881 0.372 . . . . 1.0 110.961 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 86.89 -7.87 78.38 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.922 -0.656 . . . . 1.0 112.84 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.52 126.4 29.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.618 0.247 . . . . 1.0 110.907 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.606 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 43.2 mtt85 -70.32 144.62 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 1.0 111.11 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -72.88 136.69 45.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.909 -0.587 . . . . 1.0 110.529 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.771 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -38.16 149.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.293 -0.412 . . . . 1.0 111.772 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.1 t 37.17 -91.31 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.01 -0.541 . . . . 1.0 112.163 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.76 -29.62 1.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.626 0.25 . . . . 1.0 111.156 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.8 p -179.52 71.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.782 0.325 . . . . 1.0 110.747 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.57 -84.57 1.8 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.761 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.771 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 39.7 Cg_endo -67.37 168.73 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.442 2.095 . . . . 1.0 112.479 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -101.37 -173.35 2.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.957 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' HG23 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -109.76 166.17 11.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.809 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 73.4 m -53.39 -176.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.055 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -80.04 85.61 5.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.16 -25.63 3.16 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.663 -0.78 . . . . 1.0 112.713 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -85.57 170.21 12.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.903 0.382 . . . . 1.0 110.986 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 17.1 m-85 -137.82 176.85 8.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 1.0 110.358 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 19.1 t -126.66 108.21 10.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 1.0 111.009 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.99 166.43 15.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.366 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.17 64.37 0.96 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.939 0.4 . . . . 1.0 111.253 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' MET . 0.7 OUTLIER -61.49 -162.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.403 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.14 75.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.439 -0.346 . . . . 1.0 110.925 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 178.72 149.62 0.42 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.625 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.34 -45.71 0.79 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.52 2.147 . . . . 1.0 112.415 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.606 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER -71.03 95.4 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.803 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.7 m -62.85 155.22 27.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.683 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -111.15 142.59 43.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.307 . . . . 1.0 110.962 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -119.84 123.73 44.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.203 179.484 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.96 174.19 15.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.156 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 6.3 t-20 -45.95 168.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.425 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.68 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.112 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -154.4 127.42 8.29 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 118.242 -0.885 . . . . 1.0 110.886 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.78 0 O-C-N 123.54 0.525 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.788 0.328 . . . . 1.0 111.068 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.1 p -129.03 164.51 23.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.5 m -86.89 154.27 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 1.0 111.258 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.51 -160.39 31.6 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.799 -0.715 . . . . 1.0 112.562 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.06 133.69 34.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 1.0 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.19 -1.11 81.96 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.89 -0.671 . . . . 1.0 112.813 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.39 124.57 24.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.73 0.3 . . . . 1.0 111.218 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.08 115.36 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 1.0 110.688 179.676 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.26 144.66 15.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.887 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.09 137.93 7.26 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.317 -0.401 . . . . 1.0 111.355 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.4 t 36.74 -90.83 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.988 -0.551 . . . . 1.0 112.177 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.432 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -123.3 -29.14 3.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.672 0.272 . . . . 1.0 111.172 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.23 71.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.876 0.369 . . . . 1.0 110.874 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.28 -88.49 1.41 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.774 -0.727 . . . . 1.0 112.589 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.561 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 74.0 Cg_endo -75.57 168.43 24.44 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.424 2.083 . . . . 1.0 112.377 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -97.37 175.5 6.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.78 165.35 12.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.852 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.7 m -53.63 -176.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.99 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.76 84.17 4.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.703 -0.681 . . . . 1.0 110.954 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.26 -28.16 2.71 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.667 -0.778 . . . . 1.0 112.597 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 6.0 m-30 -83.77 174.04 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 1.0 110.939 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.478 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 26.2 m-85 -142.84 179.94 6.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 1.0 110.484 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -131.4 119.41 21.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.837 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.08 164.81 11.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.039 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.4 m -132.39 60.94 1.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -56.19 -170.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.043 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -64.27 78.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.125 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.01 141.59 0.29 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.798 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.8 58.85 6.16 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.532 2.155 . . . . 1.0 112.415 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -178.85 89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.888 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.0 m -55.26 132.69 48.41 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.935 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -100.66 154.96 18.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.096 -179.534 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.74 126.61 52.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.304 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -153.88 172.42 17.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.481 -0.327 . . . . 1.0 111.039 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.465 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 3.4 t-20 -46.41 169.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.458 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 1.0 111.007 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -104.45 132.61 50.5 Favored 'General case' 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.871 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.802 0 O-C-N 123.54 0.525 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.839 0.352 . . . . 1.0 111.053 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.0 p -125.54 165.42 18.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.9 m -90.41 144.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.077 -0.51 . . . . 1.0 111.274 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.24 -160.17 2.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.854 -0.689 . . . . 1.0 112.811 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.97 128.83 35.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.837 0.351 . . . . 1.0 111.009 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 79.62 -1.57 77.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.84 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -70.55 136.11 49.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 1.0 111.238 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 22.1 mmt-85 -70.41 130.7 42.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.308 -0.405 . . . . 1.0 110.647 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.8 m -64.72 146.31 54.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.233 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.817 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.94 144.9 1.07 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.611 -0.268 . . . . 1.0 111.288 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t 37.75 -92.09 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.138 -0.483 . . . . 1.0 112.018 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.409 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.83 -28.46 2.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.613 0.244 . . . . 1.0 111.141 179.735 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p 175.48 73.24 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 1.0 110.769 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.82 -82.32 1.6 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.777 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.817 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.97 168.66 23.31 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.457 2.105 . . . . 1.0 112.421 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -96.73 -172.38 2.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.82 166.87 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 72.6 m -52.58 -176.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.112 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.9 84.2 2.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.78 -26.92 3.56 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.648 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -84.96 170.45 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.821 0.343 . . . . 1.0 110.854 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 14.8 m-85 -140.19 174.52 10.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.484 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 30.6 t -115.2 118.02 32.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.691 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.5 m -101.04 166.04 11.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.688 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.41 59.52 1.02 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.925 0.393 . . . . 1.0 111.107 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 28' ' ' MET . 2.8 ttm180 -59.35 -163.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.64 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -61.32 81.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 1.0 110.919 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 179.21 148.62 0.43 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.682 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -74.55 -22.35 15.97 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.576 2.184 . . . . 1.0 112.529 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -94.93 104.45 16.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.125 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.6 m -64.76 143.85 57.65 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.391 -0.368 . . . . 1.0 110.116 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -110.76 168.91 9.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.086 0.469 . . . . 1.0 111.682 -179.239 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -140.1 125.59 19.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.615 -0.721 . . . . 1.0 110.175 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -153.63 174.2 14.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.908 0.385 . . . . 1.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 5.2 t-20 -46.14 169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.518 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.489 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.3 p30 -69.59 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 1.0 111.103 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.0 t -146.65 138.75 24.79 Favored 'General case' 0 C--O 1.249 1.036 0 CA-C-O 118.256 -0.878 . . . . 1.0 110.875 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.737 0 O-C-N 123.528 0.518 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.86 0.362 . . . . 1.0 111.11 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.7 p -107.61 165.25 11.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 17' ' ' CYS . 19.4 m -92.66 142.94 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.506 . . . . 1.0 111.152 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.53 -160.25 7.31 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.787 -0.721 . . . . 1.0 112.782 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.05 137.12 33.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.815 0.34 . . . . 1.0 110.931 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 76.46 3.23 77.21 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.852 -0.689 . . . . 1.0 112.859 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.38 122.73 20.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.71 0.29 . . . . 1.0 111.109 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.607 ' HG2' ' CG ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -69.95 107.82 3.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.58 179.62 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.9 m -48.14 134.77 13.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.781 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.4 147.93 0.52 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.375 -0.375 . . . . 1.0 111.361 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.99 -89.56 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.02 -0.536 . . . . 1.0 112.055 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.464 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.04 -31.87 3.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.623 0.249 . . . . 1.0 111.088 179.724 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -178.25 70.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.909 0.385 . . . . 1.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.59 -89.86 1.76 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.883 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.549 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 52.6 Cg_exo -54.43 156.4 14.13 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.461 2.107 . . . . 1.0 112.54 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -101.75 146.37 27.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.656 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -68.56 161.63 27.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 1.0 111.005 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.53 -176.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.098 0.475 . . . . 1.0 110.992 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.73 85.27 2.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.861 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.56 -28.13 2.9 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.533 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.6 m-30 -85.41 173.79 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.862 0.363 . . . . 1.0 110.956 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 28.7 m-85 -145.08 179.11 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.995 -0.548 . . . . 1.0 110.376 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 38.7 t -120.46 116.33 25.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.582 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.91 162.94 13.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.053 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 39.2 m -150.02 69.9 1.03 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.735 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 ttm-85 -71.21 63.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.044 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m 48.97 81.6 0.05 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.254 -0.43 . . . . 1.0 111.256 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -156.48 169.54 10.35 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.905 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -92.05 25.52 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.123 2.548 . . . . 1.0 112.458 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.607 ' CG ' ' HG2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -174.55 93.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.588 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.4 m -56.02 153.04 9.41 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.005 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 3.2 ptt85 -115.77 161.4 18.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.975 0.417 . . . . 1.0 111.216 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 126.43 44.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.0 110.428 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.2 173.4 15.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.94 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.486 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 2.8 t-20 -45.85 168.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 1.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.475 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.2 p30 -69.7 -76.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.004 -0.544 . . . . 1.0 111.058 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.4 t -110.45 140.66 44.47 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-O 118.236 -0.888 . . . . 1.0 110.907 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.761 0 O-C-N 123.544 0.527 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.836 0.35 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.6 p -109.46 164.48 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.962 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.6 m -84.74 148.46 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 1.0 111.217 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.59 -160.22 4.13 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.802 -0.714 . . . . 1.0 112.623 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.6 136.33 33.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.862 0.363 . . . . 1.0 110.931 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 74.47 5.59 73.37 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.907 -0.663 . . . . 1.0 112.83 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.5 120.68 16.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.702 0.287 . . . . 1.0 111.089 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HD2' ' CE2' ' A' ' 30' ' ' TYR . 3.4 ptp180 -70.27 120.82 16.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.362 . . . . 1.0 110.642 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.8 m -56.17 142.4 37.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.857 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.666 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -48.92 147.48 2.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.339 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 33.93 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.995 -0.548 . . . . 1.0 112.166 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -30.32 2.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.734 0.302 . . . . 1.0 111.136 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -178.58 70.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.881 0.372 . . . . 1.0 110.756 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.76 -85.66 1.72 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.718 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.666 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 55.7 Cg_endo -70.63 168.21 23.33 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.449 2.099 . . . . 1.0 112.39 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -99.32 -176.65 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.954 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 165.47 12.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.7 m -53.89 -175.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.038 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.26 88.52 7.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.988 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.21 -25.0 3.2 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.67 -0.776 . . . . 1.0 112.806 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -87.48 170.08 11.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.872 0.368 . . . . 1.0 111.055 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.454 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.7 m-85 -137.67 174.33 10.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.397 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 40.9 t -127.41 109.81 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 1.0 110.999 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -96.57 159.5 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.776 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.1 m -129.87 59.42 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 1.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.1 -169.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.079 -0.509 . . . . 1.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -63.23 82.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 1.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.52 144.83 0.41 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.843 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.6 54.93 5.42 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.631 2.221 . . . . 1.0 112.476 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE2' ' HD2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER 176.55 97.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 1.0 110.782 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.3 m -54.94 140.61 36.68 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.336 -0.393 . . . . 1.0 110.96 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.43 142.68 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.983 -179.687 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -110.85 124.4 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 1.0 110.477 179.56 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -149.19 171.52 16.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.028 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.501 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 5.0 t-20 -51.26 170.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.206 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.454 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.63 -77.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 1.0 111.066 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.6 t -117.36 128.24 54.84 Favored 'General case' 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 1.0 110.872 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.785 0 O-C-N 123.513 0.508 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.847 0.356 . . . . 1.0 111.072 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -82.81 164.81 20.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.4 m -91.85 143.42 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 1.0 111.386 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.19 -160.32 0.82 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.766 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 21' ' ' TYR . 1.2 m-20 -88.33 128.62 35.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.876 0.369 . . . . 1.0 111.076 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 84.89 -7.59 73.79 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.92 -0.657 . . . . 1.0 112.892 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -70.87 131.0 43.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.636 0.255 . . . . 1.0 111.145 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.814 ' CD ' ' CG ' ' A' ' 30' ' ' TYR . 45.3 mtm-85 -70.11 143.42 52.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.73 0.3 . . . . 1.0 110.582 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.7 m -73.54 151.61 40.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.414 -0.357 . . . . 1.0 110.231 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.17 148.05 0.65 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.578 -0.283 . . . . 1.0 111.385 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 36.26 -89.57 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.081 -0.508 . . . . 1.0 112.061 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.443 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.9 -35.17 2.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.74 0.305 . . . . 1.0 110.873 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p 179.63 70.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 1.0 110.722 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -96.57 -82.35 1.62 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.814 -0.708 . . . . 1.0 112.669 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.742 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 56.2 Cg_endo -70.5 166.1 29.63 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.439 2.093 . . . . 1.0 112.349 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.69 -174.48 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.9 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 166.88 10.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.84 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 97.0 m -52.6 -176.66 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 1.0 111.127 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.58 83.31 2.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.581 -0.736 . . . . 1.0 110.882 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 134.66 -25.47 3.41 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -87.32 170.57 11.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.844 0.354 . . . . 1.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.7 m-85 -138.64 177.68 7.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.615 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 12.9 t -124.43 111.02 15.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.98 -0.555 . . . . 1.0 110.881 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.0 172.04 7.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.704 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 m -147.27 68.55 1.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.344 -0.389 . . . . 1.0 110.773 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -58.15 -171.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.075 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -64.85 78.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER 175.31 128.52 0.13 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.687 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.39 73.65 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 1.0 112.349 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.814 ' CG ' ' CD ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 175.88 92.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.795 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.8 m -60.53 132.11 52.88 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.551 -0.295 . . . . 1.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -101.53 153.24 19.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.76 0.314 . . . . 1.0 111.138 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -122.3 123.61 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.308 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.77 174.42 15.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.332 -0.395 . . . . 1.0 111.185 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.502 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 6.7 t-20 -44.55 167.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.656 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.65 -77.34 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.015 -0.539 . . . . 1.0 111.11 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 t -130.65 136.26 48.65 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 118.18 -0.914 . . . . 1.0 110.94 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.777 0 O-C-N 123.573 0.546 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.825 0.345 . . . . 1.0 111.01 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.2 p -128.96 164.85 22.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.964 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.7 m -115.94 143.41 25.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.905 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.408 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 170.54 -158.79 30.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.441 -0.885 . . . . 1.0 112.895 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 55.26 58.84 4.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.387 . . . . 1.0 111.156 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.65 3.71 73.5 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.928 -0.654 . . . . 1.0 112.977 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.52 131.05 43.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 1.0 111.213 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.39 124.28 23.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.689 179.509 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -60.19 137.95 58.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.563 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.716 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.46 146.71 1.96 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.404 . . . . 1.0 111.302 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t 34.78 -88.95 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.089 -0.505 . . . . 1.0 112.048 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.47 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.92 -36.08 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.745 0.307 . . . . 1.0 110.931 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 p -179.31 71.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 1.0 110.72 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -101.02 -85.69 1.88 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.858 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.716 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 31.6 Cg_exo -58.07 165.54 6.78 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.365 2.044 . . . . 1.0 112.392 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -100.12 146.85 26.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.651 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.8 158.95 30.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.893 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.9 m -54.14 -176.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.077 0.465 . . . . 1.0 110.961 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -85.45 107.21 17.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.027 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.51 -26.31 7.36 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.739 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.512 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.65 170.18 9.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 1.0 110.938 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.47 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.2 m-85 -136.76 178.79 6.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.684 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -123.31 118.69 28.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.825 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.06 129.32 46.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.846 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.9 m -106.34 47.48 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 1.0 110.821 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -57.91 -166.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.942 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -62.72 81.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 1.0 111.014 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.2 126.38 0.25 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 1.0 110.734 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.95 -27.31 44.2 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.416 2.077 . . . . 1.0 112.281 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.02 95.42 5.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.951 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.5 m -55.74 149.32 14.65 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.836 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 16.6 mtt85 -107.03 160.78 15.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.953 0.406 . . . . 1.0 111.136 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -131.6 127.78 37.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.196 179.646 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.29 174.47 14.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.741 0.305 . . . . 1.0 111.127 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.512 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.3 t-20 -43.07 165.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.57 -76.41 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.971 -0.559 . . . . 1.0 111.109 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 t -131.96 130.77 41.91 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 118.254 -0.879 . . . . 1.0 110.906 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.782 0 O-C-N 123.523 0.514 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.85 0.357 . . . . 1.0 111.058 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.18 164.71 12.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.885 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.11 148.63 4.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.296 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.73 -160.21 19.8 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.807 -0.711 . . . . 1.0 112.645 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -81.6 138.44 35.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.364 . . . . 1.0 111.031 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.42 9.93 59.09 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.956 -0.64 . . . . 1.0 112.814 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.47 127.64 33.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.682 0.277 . . . . 1.0 111.306 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.16 111.37 5.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.387 -0.37 . . . . 1.0 110.516 179.372 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 24.6 m -52.75 138.95 27.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.854 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.826 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.78 147.15 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.466 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 33.84 -89.2 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.121 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.46 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.83 -34.73 1.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.677 0.275 . . . . 1.0 110.96 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 p -177.7 70.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.404 . . . . 1.0 110.844 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.01 -81.3 1.58 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.751 -0.738 . . . . 1.0 112.749 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.826 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 51.5 Cg_endo -69.41 168.19 21.81 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.447 2.098 . . . . 1.0 112.46 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -97.4 -168.3 1.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.75 166.38 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.982 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 88.9 m -53.16 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.046 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -81.96 83.85 7.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.71 -0.677 . . . . 1.0 110.866 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.76 -26.61 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.613 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.514 ' CE1' ' ND2' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.05 170.16 10.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 1.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.473 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.5 m-85 -138.57 173.82 11.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.402 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.79 113.83 26.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.291 -0.413 . . . . 1.0 110.772 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.1 164.46 12.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.694 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.4 m -150.9 65.73 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.034 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -66.72 -163.95 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.66 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -63.44 80.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 1.0 110.911 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.37 155.04 5.98 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.824 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.55 -37.2 3.27 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.206 . . . . 1.0 112.415 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.17 122.82 40.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.047 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 36.7 m -72.01 162.65 29.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.391 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.77 172.47 11.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.087 0.47 . . . . 1.0 111.517 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.414 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -135.3 128.43 31.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.297 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -147.74 171.18 16.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.767 0.318 . . . . 1.0 111.065 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.514 ' ND2' ' CE1' ' A' ' 21' ' ' TYR . 3.9 t-20 -50.5 170.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 1.0 111.257 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.473 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.65 -76.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.062 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.15 -35.09 10.89 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 118.2 -0.905 . . . . 1.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.801 0 O-C-N 123.554 0.533 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.796 0.331 . . . . 1.0 111.039 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -132.72 164.13 27.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.9 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.4 m -91.94 144.14 9.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.084 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.71 -160.32 13.45 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.766 -0.731 . . . . 1.0 112.663 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.93 138.8 33.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.79 0.328 . . . . 1.0 110.963 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.68 3.07 71.73 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.863 -0.684 . . . . 1.0 112.933 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.35 120.12 15.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.725 0.297 . . . . 1.0 111.112 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HG2' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.1 106.57 3.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.599 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 96.3 m -48.06 133.96 14.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.314 -0.403 . . . . 1.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.452 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -42.84 144.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.87 -90.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.931 -0.577 . . . . 1.0 112.117 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.58 -25.85 3.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.633 0.254 . . . . 1.0 111.238 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 p 178.92 71.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.856 0.36 . . . . 1.0 110.905 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.01 -95.72 1.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.631 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.452 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.9 Cg_exo -53.18 164.3 1.88 Allowed 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.311 2.008 . . . . 1.0 112.444 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -107.08 149.41 27.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.439 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -71.54 160.27 33.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.86 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.74 -176.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.978 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -77.02 84.25 3.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.911 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 139.27 -27.07 2.66 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.754 -0.736 . . . . 1.0 112.607 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.476 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.2 m-30 -88.07 173.3 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.847 0.356 . . . . 1.0 110.943 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.48 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 24.5 m-85 -141.68 179.2 6.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.419 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.0 t -125.83 114.17 18.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.811 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.89 154.01 17.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 1.0 110.948 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.15 57.53 1.39 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.874 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -175.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.9 82.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.958 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.78 145.15 0.46 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.812 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -79.69 54.74 5.33 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.691 2.261 . . . . 1.0 112.46 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CD1' ' HG2' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.85 89.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.777 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.8 m -55.03 144.41 23.59 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.918 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -111.24 158.01 19.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.953 0.406 . . . . 1.0 111.031 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.93 127.64 54.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.604 179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -152.54 171.66 17.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.855 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.476 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.2 t-20 -47.09 170.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 1.0 111.361 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.48 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.6 -76.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.088 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -129.89 121.76 27.28 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 118.249 -0.882 . . . . 1.0 110.885 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.787 0 O-C-N 123.576 0.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.779 0.323 . . . . 1.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.8 p -106.5 165.2 11.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -132.77 143.44 39.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.971 -0.558 . . . . 1.0 110.935 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 178.34 -158.06 22.46 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.438 -0.887 . . . . 1.0 113.001 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 56.55 66.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.909 0.385 . . . . 1.0 111.147 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.27 -2.73 80.63 Favored Glycine 0 CA--C 1.52 0.347 0 C-N-CA 120.948 -0.644 . . . . 1.0 112.912 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.57 119.09 14.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.724 0.262 . . . . 1.0 111.182 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 2.7 ptp180 -70.26 119.19 14.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.946 0.403 . . . . 1.0 110.623 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.69 140.41 23.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.035 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -46.59 147.89 1.12 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.254 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.939 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.457 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.32 -24.41 3.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.635 0.255 . . . . 1.0 111.1 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 p 175.02 73.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.824 0.345 . . . . 1.0 110.708 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.73 -94.12 2.02 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.753 -0.737 . . . . 1.0 112.902 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 44.0 Cg_exo -55.98 161.21 8.86 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.357 2.038 . . . . 1.0 112.466 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -96.19 152.58 18.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.678 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.14 156.85 28.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 1.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 74.4 m -53.76 -176.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.105 0.479 . . . . 1.0 110.959 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.16 93.96 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.782 -0.645 . . . . 1.0 111.036 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.45 3.52 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.656 -0.783 . . . . 1.0 112.778 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.511 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.15 170.1 9.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 1.0 111.05 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.3 m-85 -137.3 179.12 6.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.372 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 t -126.24 113.76 17.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.455 . . . . 1.0 111.004 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.45 139.43 32.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.529 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.5 m -116.19 52.38 0.92 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.962 0.411 . . . . 1.0 111.006 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.8 ttm180 -58.46 -163.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.769 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.57 81.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.487 -0.324 . . . . 1.0 110.978 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 178.96 147.8 0.4 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.726 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.79 -34.67 6.56 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.548 2.165 . . . . 1.0 112.252 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.449 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -97.01 96.45 8.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.835 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.4 m -55.45 151.55 10.06 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.492 -0.322 . . . . 1.0 110.731 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -108.58 142.39 39.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.884 0.373 . . . . 1.0 111.115 -179.546 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.461 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -114.22 124.02 51.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.122 179.453 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.31 174.05 15.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.157 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.511 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 6.9 t-20 -43.2 165.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.462 . . . . 1.0 111.675 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.56 -77.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.091 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.71 126.31 44.29 Favored 'General case' 0 C--O 1.249 1.06 0 CA-C-O 118.231 -0.89 . . . . 1.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.779 0 CA-C-N 118.295 0.498 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.866 0.365 . . . . 1.0 110.992 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.6 p -147.46 165.6 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 1.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.88 149.16 26.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.894 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 167.59 -158.4 31.24 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.37 -0.919 . . . . 1.0 112.905 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 56.13 58.74 4.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.385 . . . . 1.0 111.216 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.23 -0.52 83.85 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.824 -0.703 . . . . 1.0 113.011 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.26 129.32 39.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.778 0.323 . . . . 1.0 111.264 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.49 122.9 20.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 1.0 110.585 179.541 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 7.5 m -55.54 141.22 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.496 -0.32 . . . . 1.0 110.614 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.658 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -49.24 145.16 4.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.363 -0.38 . . . . 1.0 111.216 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.85 -89.0 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.042 -0.526 . . . . 1.0 112.053 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.471 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -35.83 2.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.731 0.301 . . . . 1.0 111.01 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.7 p -179.57 71.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.889 0.376 . . . . 1.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.29 -87.48 1.93 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.739 -0.744 . . . . 1.0 112.735 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.658 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 38.6 Cg_exo -59.77 168.26 5.82 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.401 2.068 . . . . 1.0 112.36 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -105.12 147.11 28.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.634 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.64 158.06 36.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.863 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.7 m -53.84 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.107 0.48 . . . . 1.0 111.079 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -82.6 105.06 13.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.974 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.08 -25.94 6.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.652 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.02 170.53 9.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.788 0.328 . . . . 1.0 110.959 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -136.48 179.85 6.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.696 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.5 t -126.31 114.83 18.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -99.02 168.84 9.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.428 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.3 m -148.71 66.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.912 0.387 . . . . 1.0 111.189 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -162.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.55 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.8 m -67.21 66.95 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 5.2 mmt -159.98 135.46 5.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.729 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.17 -29.52 75.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.398 2.065 . . . . 1.0 112.432 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.21 119.72 36.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 1.0 111.126 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.3 m -71.84 151.01 43.77 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.291 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -110.44 154.91 22.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.858 0.361 . . . . 1.0 111.267 -179.282 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.441 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -131.1 127.54 38.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.068 -0.514 . . . . 1.0 110.1 179.406 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -162.29 173.78 13.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.747 0.308 . . . . 1.0 111.154 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.508 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 5.7 t-20 -43.16 165.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.709 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.468 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.58 -76.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.096 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.59 125.71 53.68 Favored 'General case' 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 1.0 110.926 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.797 0 O-C-N 123.533 0.52 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.835 0.35 . . . . 1.0 111.031 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.92 164.32 12.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.943 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -81.98 147.29 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.267 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.15 -160.11 7.98 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.85 -0.69 . . . . 1.0 112.623 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.98 138.76 33.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.863 0.363 . . . . 1.0 110.995 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.92 12.75 58.07 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.864 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.4 127.77 33.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 1.0 111.09 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.2 111.22 5.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.623 179.554 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' CE1' ' A' ' 30' ' ' TYR . 70.5 m -52.87 134.44 37.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.744 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.749 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -43.68 143.88 0.92 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.575 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.17 -90.13 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.945 -0.57 . . . . 1.0 112.151 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.445 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.39 -30.46 1.91 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.663 0.268 . . . . 1.0 111.262 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -178.71 70.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.819 0.342 . . . . 1.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.65 -84.0 1.75 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.755 -0.736 . . . . 1.0 112.743 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.749 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.6 Cg_endo -71.61 168.56 23.3 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.472 2.115 . . . . 1.0 112.443 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -97.51 -170.8 2.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.964 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.464 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.1 OUTLIER -115.55 165.75 12.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.883 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.6 m -53.51 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 1.0 111.059 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.84 84.22 7.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.877 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.01 -26.6 2.6 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.703 -0.761 . . . . 1.0 112.594 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.524 ' CE1' ' ND2' ' A' ' 35' ' ' ASN . 2.7 m-30 -90.38 169.82 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.34 . . . . 1.0 110.939 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.2 m-85 -137.2 174.17 10.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.432 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 51.8 t -113.29 113.21 24.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.312 -0.403 . . . . 1.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 t -94.16 167.47 11.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 1.0 110.665 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 62.8 m -150.62 63.86 0.94 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.956 0.408 . . . . 1.0 111.085 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -63.31 -163.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.604 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.17 81.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 1.0 110.871 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.28 149.69 0.68 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.848 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.95 -36.68 7.29 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 1.0 112.371 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.451 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER -90.19 112.21 23.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.932 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.01 162.16 22.7 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.555 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -126.29 170.22 12.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.009 0.433 . . . . 1.0 111.387 -179.634 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.06 129.53 34.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.796 -0.638 . . . . 1.0 110.409 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -151.13 169.97 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 1.0 110.976 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.524 ' ND2' ' CE1' ' A' ' 21' ' ' TYR . 4.1 t-20 -49.09 170.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 1.0 111.276 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.67 -76.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.999 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.4 p -150.49 136.14 18.18 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 118.174 -0.917 . . . . 1.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.248 -3.809 0 O-C-N 123.603 0.565 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.854 0.359 . . . . 1.0 111.04 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HB2' ' N ' ' A' ' 18' ' ' CYS . 27.9 p -125.91 166.55 16.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.983 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.51 HG12 ' CG ' ' A' ' 7' ' ' GLN . 0.1 OUTLIER -93.25 164.76 2.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.096 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.71 -160.71 32.45 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.859 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -88.19 132.48 34.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.891 0.377 . . . . 1.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.39 6.96 59.59 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.961 -0.637 . . . . 1.0 112.826 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.51 ' CG ' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.97 129.48 39.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.584 0.231 . . . . 1.0 111.23 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.37 112.22 6.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.969 0.414 . . . . 1.0 110.562 179.507 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 19.2 m -50.51 139.84 15.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.312 -0.404 . . . . 1.0 110.856 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.31 145.84 0.76 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.404 -0.362 . . . . 1.0 111.314 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 35.49 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.729 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.462 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -142.48 5.03 1.6 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.473 0.175 . . . . 1.0 111.473 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 12' ' ' TRP . 1.7 p 163.31 77.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.717 0.294 . . . . 1.0 110.558 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.66 -100.06 2.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.602 -0.809 . . . . 1.0 113.063 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.455 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.5 Cg_exo -53.15 165.95 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.426 2.084 . . . . 1.0 112.705 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -108.94 149.39 29.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 1.0 110.618 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.09 157.35 38.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 1.0 111.026 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 21' ' ' TYR . 76.1 m -62.45 -176.62 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.914 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.43 94.04 2.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.98 -9.24 7.12 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.739 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 2.0 m-85 -110.62 170.75 7.89 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.749 0.309 . . . . 1.0 110.775 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 36' ' ' ASN . 18.5 m-85 -142.44 173.64 11.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.266 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.4 t -117.35 114.43 23.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.25 -0.432 . . . . 1.0 111.188 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -95.77 169.47 9.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.37 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 85.3 m -151.32 70.29 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 1.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -62.12 -164.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.635 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -69.5 65.06 0.18 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.903 0.382 . . . . 1.0 111.159 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 9.1 mmt -155.83 157.12 31.3 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.788 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.48 -45.52 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.514 2.142 . . . . 1.0 112.378 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.54 107.57 16.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 1.0 110.857 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 9' ' ' CYS . 35.6 m -61.21 167.6 3.03 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.253 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -128.21 164.25 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.085 0.469 . . . . 1.0 111.795 -179.413 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.443 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.21 124.96 23.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.189 179.588 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -145.21 172.68 12.78 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.831 0.348 . . . . 1.0 111.096 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.451 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 3.6 t-20 -50.97 171.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.923 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HA ' ' CD2' ' A' ' 22' ' ' TYR . 1.4 p30 -69.9 -77.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.985 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 m -133.68 124.16 26.25 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-O 118.194 -0.908 . . . . 1.0 110.887 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.782 0 O-C-N 123.545 0.528 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.794 0.331 . . . . 1.0 111.071 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.9 p -164.49 163.91 21.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.93 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.3 m -92.63 145.27 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 1.0 111.129 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.05 -160.95 8.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.811 -0.709 . . . . 1.0 112.715 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.71 135.0 33.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 1.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.01 0.87 77.6 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 1.0 112.772 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.45 128.39 36.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.726 0.298 . . . . 1.0 111.229 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.32 115.5 9.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 1.0 110.556 179.501 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 64.1 m -55.77 135.65 51.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.436 -0.347 . . . . 1.0 110.561 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.55 146.44 0.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.543 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.38 -90.03 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.042 -0.527 . . . . 1.0 111.986 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.65 -23.75 3.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.599 0.238 . . . . 1.0 111.305 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p 177.36 72.54 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.885 0.374 . . . . 1.0 110.764 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.19 -94.24 2.06 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.822 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.534 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 51.3 Cg_exo -53.48 165.1 1.73 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.353 2.035 . . . . 1.0 112.574 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -108.49 149.44 28.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.653 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 157.22 38.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -57.28 -176.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.088 0.47 . . . . 1.0 110.957 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -75.68 87.47 2.74 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 135.75 -27.31 3.08 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.524 ' CE1' ' ND2' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.33 170.45 9.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.723 0.297 . . . . 1.0 110.783 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.491 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.1 m-85 -139.71 173.59 11.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.572 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.2 t -111.43 112.99 25.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.687 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.94 166.03 12.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.695 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.5 m -151.22 66.42 0.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.985 0.422 . . . . 1.0 110.993 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -68.17 -163.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.663 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -63.83 79.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.1 141.07 0.42 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.778 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.02 -62.68 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.469 2.112 . . . . 1.0 112.294 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.88 115.02 6.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.999 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.1 m -69.6 169.32 12.93 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.326 -0.397 . . . . 1.0 110.329 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.1 170.02 14.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.07 0.462 . . . . 1.0 111.467 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.419 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -139.43 126.89 21.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.394 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.27 173.34 15.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 1.0 111.054 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.524 ' ND2' ' CE1' ' A' ' 21' ' ' TYR . 4.3 t-20 -47.51 170.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.406 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.491 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.2 p30 -69.54 -76.43 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 1.0 111.042 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.4 136.2 53.88 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.788 0 O-C-N 123.547 0.529 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.823 0.344 . . . . 1.0 111.041 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p -137.21 163.52 30.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 1.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 m -111.83 162.96 9.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.058 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.16 -160.32 31.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.645 -0.788 . . . . 1.0 112.595 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 53.13 63.75 2.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.883 0.373 . . . . 1.0 111.074 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.39 2.02 83.08 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.901 -0.666 . . . . 1.0 112.871 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -70.34 123.2 21.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.736 0.303 . . . . 1.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.18 122.78 20.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.814 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 79.8 m -59.62 142.11 53.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.521 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.71 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.18 140.6 3.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.371 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.21 -90.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.005 -0.543 . . . . 1.0 112.098 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.81 -29.74 2.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.697 0.284 . . . . 1.0 111.129 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p 178.23 72.14 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 1.0 110.771 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.45 -91.58 1.57 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.701 -0.762 . . . . 1.0 112.74 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.71 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 71.9 Cg_endo -75.19 168.53 24.5 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.471 2.114 . . . . 1.0 112.466 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -81.62 -170.49 2.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.38 165.79 20.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.505 . . . . 1.0 110.796 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.8 m -53.68 -176.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.99 -0.55 . . . . 1.0 111.045 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -93.59 124.75 37.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.749 -0.659 . . . . 1.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.85 -27.69 14.11 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.709 -0.757 . . . . 1.0 112.623 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.67 170.32 9.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.838 0.351 . . . . 1.0 110.933 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 16.3 m-85 -135.82 177.19 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.053 -0.522 . . . . 1.0 110.411 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.7 t -127.67 110.69 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.973 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -99.2 170.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.68 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.6 m -142.17 65.75 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -60.08 -168.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.91 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 m -64.99 78.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.034 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.432 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER 179.71 129.74 0.24 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.725 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 18.9 Cg_exo -66.26 63.76 0.49 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.527 2.152 . . . . 1.0 112.307 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 177.13 94.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.861 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -56.97 136.36 56.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.782 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.97 142.64 34.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.94 0.4 . . . . 1.0 111.095 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -109.11 124.97 51.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.422 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -153.04 170.83 19.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.446 -0.343 . . . . 1.0 111.014 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.5 t-20 -46.39 168.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.332 -0.394 . . . . 1.0 111.454 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.72 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 1.0 111.077 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.5 t -104.97 139.42 39.69 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-O 118.272 -0.87 . . . . 1.0 110.896 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.763 0 O-C-N 123.479 0.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.858 0.361 . . . . 1.0 111.009 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p -133.81 164.13 27.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.969 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.469 HG12 ' OE1' ' A' ' 7' ' ' GLN . 6.1 m -116.62 163.87 13.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 1.0 111.037 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.17 -160.25 31.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.676 -0.773 . . . . 1.0 112.67 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 t70 53.59 66.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 1.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.05 -2.09 82.31 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.963 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.469 ' OE1' HG12 ' A' ' 3' ' ' VAL . 0.4 OUTLIER -70.59 116.62 11.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.652 0.263 . . . . 1.0 111.117 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.3 118.51 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.888 0.375 . . . . 1.0 110.879 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 88.0 m -51.23 138.92 19.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.93 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.729 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.46 146.04 0.76 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.482 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.4 t 34.8 -90.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.963 -0.562 . . . . 1.0 112.032 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.456 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.88 -30.58 2.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 1.0 111.034 179.764 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.1 p -179.44 71.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.858 0.361 . . . . 1.0 110.641 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.52 -91.01 1.75 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.757 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.729 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 58.9 Cg_endo -72.17 168.25 24.6 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.442 2.094 . . . . 1.0 112.478 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -87.26 -175.06 5.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.84 164.92 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.868 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.8 m -54.1 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.01 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -93.5 118.46 31.37 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.668 -0.697 . . . . 1.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 115.16 -27.43 8.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.708 -0.758 . . . . 1.0 112.636 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.506 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.51 170.2 9.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.897 0.379 . . . . 1.0 110.892 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 15.0 m-85 -135.77 176.24 8.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.239 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 t -127.65 109.19 11.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.34 151.07 21.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 1.0 110.448 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.51 56.56 1.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 1.0 111.088 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -59.48 -175.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.839 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -61.28 85.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 1.0 111.006 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.35 145.12 0.43 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.862 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.02 54.34 5.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.67 2.247 . . . . 1.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 174.41 92.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.64 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.75 144.46 14.19 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.454 -0.339 . . . . 1.0 110.764 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.58 141.97 35.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.35 . . . . 1.0 111.023 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -114.09 122.22 46.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.219 179.431 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.66 172.02 16.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.291 -0.413 . . . . 1.0 111.125 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.506 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.5 t-20 -46.0 168.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.455 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.59 -76.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.085 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.36 132.16 55.7 Favored 'General case' 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 1.0 110.887 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.248 -3.808 0 O-C-N 123.519 0.512 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.851 0.358 . . . . 1.0 111.029 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p -129.72 164.17 24.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.964 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.9 m -112.97 163.04 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.947 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.97 -160.02 30.06 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.573 -0.822 . . . . 1.0 112.738 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.58 52.5 12.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.872 0.368 . . . . 1.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.11 -0.16 83.62 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.858 -0.686 . . . . 1.0 112.949 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.29 126.46 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.74 0.305 . . . . 1.0 111.02 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 1.5 mpp_? -70.15 124.85 25.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.37 . . . . 1.0 110.835 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.9 m -57.97 138.97 55.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.268 -0.423 . . . . 1.0 110.605 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.875 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.38 143.62 1.73 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.393 . . . . 1.0 111.449 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.3 t 35.43 -89.31 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.985 -0.552 . . . . 1.0 112.128 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.461 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.15 -38.76 1.59 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.718 0.294 . . . . 1.0 110.802 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.3 p -177.12 69.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 1.0 110.787 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.06 -81.26 1.59 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.728 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.875 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 61.4 Cg_endo -73.39 167.76 26.47 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.451 2.1 . . . . 1.0 112.44 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -89.05 -171.64 3.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.03 164.39 20.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.815 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.8 m -54.16 -176.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.157 0.503 . . . . 1.0 110.932 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -90.88 122.54 33.67 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 1.0 111.083 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.98 -26.3 17.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 1.0 112.661 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.4 m-30 -95.66 170.72 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.825 0.345 . . . . 1.0 111.059 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.465 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.5 m-85 -135.85 178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.595 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.4 t -127.53 105.94 8.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.974 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.48 170.27 10.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.704 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 m -147.18 68.27 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.318 -0.401 . . . . 1.0 110.881 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm-85 -62.04 -171.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.95 80.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.991 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.09 144.04 0.49 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.859 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.16 58.21 6.12 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.619 2.212 . . . . 1.0 112.449 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.78 97.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.844 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -58.98 147.17 35.43 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.706 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 1.0 111.087 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.02 125.55 54.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.327 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 173.23 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.134 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.5 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 39.5 t30 -45.0 167.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.501 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.465 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.72 -76.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.045 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 p -131.88 134.12 45.37 Favored 'General case' 0 C--O 1.249 1.042 0 CA-C-O 118.22 -0.895 . . . . 1.0 110.928 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.766 0 O-C-N 123.53 0.519 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.802 0.334 . . . . 1.0 111.086 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p -145.08 163.69 33.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.941 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.417 HG12 ' NE2' ' A' ' 7' ' ' GLN . 6.0 m -99.46 143.39 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 1.0 110.854 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.29 174.05 44.22 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.45 -0.881 . . . . 1.0 113.032 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.27 75.21 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.874 0.369 . . . . 1.0 111.349 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 72.07 6.4 64.3 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.006 -0.616 . . . . 1.0 113.211 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' NE2' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.54 118.95 13.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.934 0.367 . . . . 1.0 111.215 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.18 109.52 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.661 179.581 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.73 139.72 12.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.383 -0.371 . . . . 1.0 110.902 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.774 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.51 141.29 2.78 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.59 -89.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.973 -0.558 . . . . 1.0 112.201 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.454 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.23 -36.42 2.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.722 0.296 . . . . 1.0 110.983 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -178.67 70.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.11 -91.05 1.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 1.0 112.647 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.774 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.58 168.33 23.93 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.467 2.111 . . . . 1.0 112.397 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -78.12 -175.32 4.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 t -117.67 165.25 13.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 66.1 m -53.62 -176.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 1.0 111.056 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -94.44 118.03 31.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.057 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.16 -29.47 9.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.583 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.52 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.3 m-30 -97.33 169.81 9.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.777 0.322 . . . . 1.0 110.831 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.2 m-85 -133.39 175.31 9.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 1.0 110.396 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.3 t -119.12 112.68 19.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.001 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -95.93 151.19 19.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.811 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.0 m -127.08 57.73 1.46 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 1.0 110.962 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -61.63 -171.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.834 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -62.81 83.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.056 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.93 143.53 0.49 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.806 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.77 53.42 4.77 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.709 2.273 . . . . 1.0 112.576 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER 177.33 90.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 1.0 110.82 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.2 m -55.26 142.76 30.43 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.889 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -112.77 153.79 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.947 0.403 . . . . 1.0 111.134 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -112.31 125.22 53.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.556 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -146.37 166.46 26.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.52 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 3.9 t-20 -45.69 168.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 1.0 111.486 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.71 -77.02 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 1.0 111.073 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.4 130.25 45.66 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-O 118.29 -0.862 . . . . 1.0 110.921 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.748 0 O-C-N 123.503 0.502 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.815 0.34 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -140.82 164.5 30.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.917 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.1 m -121.92 162.51 21.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.071 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 161.52 -159.12 30.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.598 -0.811 . . . . 1.0 112.851 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 t70 55.23 60.43 3.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 1.0 111.241 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.1 -0.58 83.13 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.826 -0.702 . . . . 1.0 112.955 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -70.25 133.61 47.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 1.0 111.25 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.43 124.7 24.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.687 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -58.19 144.56 40.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.542 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.863 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -51.81 141.23 17.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.49 -0.323 . . . . 1.0 111.048 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 35.42 -88.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.073 -0.512 . . . . 1.0 112.101 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.474 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.45 -39.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.75 0.31 . . . . 1.0 110.883 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 p -178.22 70.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.721 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.92 -81.81 1.62 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.702 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.863 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 60.6 Cg_endo -73.21 168.25 25.22 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 122.347 2.032 . . . . 1.0 112.379 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -96.78 159.83 14.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.58 164.65 15.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -53.79 -176.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.96 113.93 22.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.976 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 113.31 -26.51 10.27 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.743 -0.741 . . . . 1.0 112.629 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.5 m-30 -95.48 170.89 9.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 1.0 111.023 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 22.0 m-85 -136.49 -179.3 5.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.683 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.9 t -126.02 119.05 26.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.948 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.2 m -101.48 166.91 10.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.492 . . . . 1.0 110.42 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.1 m -149.08 53.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.895 0.379 . . . . 1.0 111.065 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.55 -163.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 1.0 110.568 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -60.19 83.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.839 0.352 . . . . 1.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.417 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.1 OUTLIER -177.85 131.21 0.32 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.71 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 48.7 Cg_exo -55.96 -26.53 59.12 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 1.0 112.518 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.67 125.44 48.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.417 -0.356 . . . . 1.0 111.211 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.44 146.02 43.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.203 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 24' ' ' SER . 0.1 OUTLIER -108.12 160.85 15.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 1.0 111.436 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.408 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.36 130.43 32.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.189 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -164.13 173.71 12.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.771 0.319 . . . . 1.0 111.013 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.494 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 7.3 t-20 -43.07 164.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.582 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.69 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.043 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.8 t -111.1 111.66 22.92 Favored 'General case' 0 C--O 1.249 1.055 0 CA-C-O 118.259 -0.876 . . . . 1.0 110.895 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.76 0 O-C-N 123.479 0.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.786 0.327 . . . . 1.0 111.046 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -123.02 164.21 19.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.904 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -85.45 149.5 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.231 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.16 -160.22 17.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 1.0 112.568 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.41 133.07 33.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.356 . . . . 1.0 110.959 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.06 -1.79 83.46 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.794 -0.717 . . . . 1.0 112.928 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.36 126.26 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.732 0.301 . . . . 1.0 111.144 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.11 121.49 17.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.792 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -59.02 142.37 51.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.762 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.645 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.85 142.38 3.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.422 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.013 -0.539 . . . . 1.0 112.19 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.29 -31.36 3.06 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 1.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -179.03 70.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.833 0.349 . . . . 1.0 110.851 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -92.95 -86.46 1.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.694 -0.765 . . . . 1.0 112.629 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.645 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 63.4 Cg_endo -74.09 168.21 25.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.415 2.077 . . . . 1.0 112.378 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -99.28 173.1 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -94.81 165.3 12.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.911 179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 84.4 m -53.95 -176.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.988 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.12 84.23 5.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.691 -0.686 . . . . 1.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.77 -25.8 2.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.672 -0.775 . . . . 1.0 112.674 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 4.1 m-30 -87.51 171.68 10.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.853 0.359 . . . . 1.0 110.98 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.456 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -138.54 178.97 6.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.0 110.589 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.6 t -129.76 114.83 16.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -102.7 173.92 6.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 1.0 110.959 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.5 m -145.13 66.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.868 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.46 -167.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.833 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -65.11 78.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.966 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.47 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER -179.83 128.49 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.732 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 20.2 Cg_exo -65.72 64.09 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.54 2.16 . . . . 1.0 112.334 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.441 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.79 94.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.796 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.6 m -57.21 134.68 56.13 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.946 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -103.31 153.65 20.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 1.0 111.005 -179.621 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.3 128.42 54.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.448 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.48 172.23 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.032 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.475 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 4.8 t-20 -46.74 169.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.0 111.447 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.6 p30 -69.72 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.077 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.64 -166.0 1.11 Allowed 'General case' 0 C--O 1.249 1.044 0 CA-C-O 118.209 -0.9 . . . . 1.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.785 0 O-C-N 123.578 0.549 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.864 0.364 . . . . 1.0 110.871 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.433 HG23 ' SG ' ' A' ' 17' ' ' CYS . 13.5 m -84.26 142.83 12.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.181 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.13 -160.36 1.63 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 1.0 112.581 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.63 128.22 36.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.881 0.372 . . . . 1.0 110.961 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 86.89 -7.87 78.38 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.922 -0.656 . . . . 1.0 112.84 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.52 126.4 29.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.618 0.247 . . . . 1.0 110.907 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.606 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 43.2 mtt85 -70.32 144.62 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 1.0 111.11 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -72.88 136.69 45.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.909 -0.587 . . . . 1.0 110.529 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.771 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -38.16 149.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.293 -0.412 . . . . 1.0 111.772 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.1 t 37.17 -91.31 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.01 -0.541 . . . . 1.0 112.163 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.76 -29.62 1.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.626 0.25 . . . . 1.0 111.156 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.8 p -179.52 71.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.782 0.325 . . . . 1.0 110.747 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.57 -84.57 1.8 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.761 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.771 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 39.7 Cg_endo -67.37 168.73 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.442 2.095 . . . . 1.0 112.479 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -101.37 -173.35 2.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.957 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' HG23 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -109.76 166.17 11.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.809 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 73.4 m -53.39 -176.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.055 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -80.04 85.61 5.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.16 -25.63 3.16 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.663 -0.78 . . . . 1.0 112.713 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -85.57 170.21 12.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.903 0.382 . . . . 1.0 110.986 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 17.1 m-85 -137.82 176.85 8.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 1.0 110.358 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 19.1 t -126.66 108.21 10.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 1.0 111.009 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.99 166.43 15.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.366 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.17 64.37 0.96 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.939 0.4 . . . . 1.0 111.253 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' MET . 0.7 OUTLIER -61.49 -162.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.403 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.14 75.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.439 -0.346 . . . . 1.0 110.925 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 178.72 149.62 0.42 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.625 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.34 -45.71 0.79 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.52 2.147 . . . . 1.0 112.415 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.606 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER -71.03 95.4 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.803 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.7 m -62.85 155.22 27.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.683 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -111.15 142.59 43.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.307 . . . . 1.0 110.962 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -119.84 123.73 44.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.203 179.484 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.96 174.19 15.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.156 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.1 t30 -45.95 168.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.425 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.68 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.112 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.242 -0.885 . . . . 1.0 110.886 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.1 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.847 0.356 . . . . 1.0 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.5 m -86.89 154.27 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 1.0 111.258 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.51 -160.39 31.6 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.799 -0.715 . . . . 1.0 112.562 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.06 133.69 34.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 1.0 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.19 -1.11 81.96 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.89 -0.671 . . . . 1.0 112.813 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.39 124.57 24.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.73 0.3 . . . . 1.0 111.218 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.08 115.36 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 1.0 110.688 179.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.26 144.66 15.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.887 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.09 137.93 7.26 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.317 -0.401 . . . . 1.0 111.355 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.4 t 36.74 -90.83 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.988 -0.551 . . . . 1.0 112.177 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.432 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -123.3 -29.14 3.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.672 0.272 . . . . 1.0 111.172 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.23 71.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.876 0.369 . . . . 1.0 110.874 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.28 -88.49 1.41 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.774 -0.727 . . . . 1.0 112.589 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.561 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 74.0 Cg_endo -75.57 168.43 24.44 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.424 2.083 . . . . 1.0 112.377 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -97.37 175.5 6.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.78 165.35 12.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.852 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.7 m -53.63 -176.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.99 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.76 84.17 4.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.703 -0.681 . . . . 1.0 110.954 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.26 -28.16 2.71 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.667 -0.778 . . . . 1.0 112.597 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 6.0 m-30 -83.77 174.04 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 1.0 110.939 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.478 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 26.2 m-85 -142.84 179.94 6.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 1.0 110.484 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -131.4 119.41 21.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.837 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.08 164.81 11.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.039 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.4 m -132.39 60.94 1.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -56.19 -170.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.043 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -64.27 78.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.125 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.01 141.59 0.29 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.798 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.8 58.85 6.16 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.532 2.155 . . . . 1.0 112.415 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -178.85 89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.888 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.0 m -55.26 132.69 48.41 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.935 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -100.66 154.96 18.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.096 -179.534 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.74 126.61 52.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.304 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -153.88 172.42 17.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.481 -0.327 . . . . 1.0 111.039 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.465 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 37.1 t30 -46.41 169.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.458 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 1.0 111.007 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.871 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.9 m -90.41 144.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.077 -0.51 . . . . 1.0 111.274 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.24 -160.17 2.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.854 -0.689 . . . . 1.0 112.811 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.97 128.83 35.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.837 0.351 . . . . 1.0 111.009 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 79.62 -1.57 77.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.84 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -70.55 136.11 49.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 1.0 111.238 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 22.1 mmt-85 -70.41 130.7 42.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.308 -0.405 . . . . 1.0 110.647 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.8 m -64.72 146.31 54.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.233 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.817 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.94 144.9 1.07 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.611 -0.268 . . . . 1.0 111.288 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t 37.75 -92.09 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.138 -0.483 . . . . 1.0 112.018 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.409 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.83 -28.46 2.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.613 0.244 . . . . 1.0 111.141 179.735 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p 175.48 73.24 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 1.0 110.769 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.82 -82.32 1.6 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.777 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.817 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.97 168.66 23.31 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.457 2.105 . . . . 1.0 112.421 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -96.73 -172.38 2.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.82 166.87 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 72.6 m -52.58 -176.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.112 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.9 84.2 2.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.78 -26.92 3.56 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.648 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -84.96 170.45 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.821 0.343 . . . . 1.0 110.854 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 14.8 m-85 -140.19 174.52 10.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.484 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 30.6 t -115.2 118.02 32.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.691 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.5 m -101.04 166.04 11.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.688 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.41 59.52 1.02 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.925 0.393 . . . . 1.0 111.107 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 28' ' ' MET . 2.8 ttm180 -59.35 -163.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.64 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -61.32 81.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 1.0 110.919 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 179.21 148.62 0.43 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.682 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -74.55 -22.35 15.97 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.576 2.184 . . . . 1.0 112.529 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -94.93 104.45 16.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.125 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.6 m -64.76 143.85 57.65 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.391 -0.368 . . . . 1.0 110.116 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -110.76 168.91 9.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.086 0.469 . . . . 1.0 111.682 -179.239 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -140.1 125.59 19.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.615 -0.721 . . . . 1.0 110.175 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -153.63 174.2 14.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.908 0.385 . . . . 1.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.6 t30 -46.14 169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.518 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.489 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.3 p30 -69.59 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 1.0 111.103 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.256 -0.878 . . . . 1.0 110.875 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.86 0.362 . . . . 1.0 110.9 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 17' ' ' CYS . 19.4 m -92.66 142.94 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.506 . . . . 1.0 111.152 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.53 -160.25 7.31 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.787 -0.721 . . . . 1.0 112.782 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.05 137.12 33.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.815 0.34 . . . . 1.0 110.931 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 76.46 3.23 77.21 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.852 -0.689 . . . . 1.0 112.859 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.38 122.73 20.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.71 0.29 . . . . 1.0 111.109 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.607 ' HG2' ' CG ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -69.95 107.82 3.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.58 179.62 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.9 m -48.14 134.77 13.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.781 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.4 147.93 0.52 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.375 -0.375 . . . . 1.0 111.361 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.99 -89.56 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.02 -0.536 . . . . 1.0 112.055 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.464 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.04 -31.87 3.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.623 0.249 . . . . 1.0 111.088 179.724 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -178.25 70.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.909 0.385 . . . . 1.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.59 -89.86 1.76 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.883 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.549 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 52.6 Cg_exo -54.43 156.4 14.13 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.461 2.107 . . . . 1.0 112.54 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -101.75 146.37 27.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.656 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -68.56 161.63 27.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 1.0 111.005 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.53 -176.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.098 0.475 . . . . 1.0 110.992 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.73 85.27 2.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.861 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.56 -28.13 2.9 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.533 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.6 m-30 -85.41 173.79 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.862 0.363 . . . . 1.0 110.956 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 28.7 m-85 -145.08 179.11 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.995 -0.548 . . . . 1.0 110.376 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 38.7 t -120.46 116.33 25.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.582 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.91 162.94 13.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.053 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 39.2 m -150.02 69.9 1.03 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.735 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 ttm-85 -71.21 63.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.044 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m 48.97 81.6 0.05 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.254 -0.43 . . . . 1.0 111.256 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -156.48 169.54 10.35 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.905 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -92.05 25.52 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.123 2.548 . . . . 1.0 112.458 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.607 ' CG ' ' HG2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -174.55 93.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.588 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.4 m -56.02 153.04 9.41 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.005 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 3.2 ptt85 -115.77 161.4 18.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.975 0.417 . . . . 1.0 111.216 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 126.43 44.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.0 110.428 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.2 173.4 15.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.94 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.486 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 47.1 t30 -45.85 168.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 1.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.475 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.2 p30 -69.7 -76.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.004 -0.544 . . . . 1.0 111.058 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.4 t . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.236 -0.888 . . . . 1.0 110.907 179.962 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.6 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.858 0.361 . . . . 1.0 110.962 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.6 m -84.74 148.46 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 1.0 111.217 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.59 -160.22 4.13 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.802 -0.714 . . . . 1.0 112.623 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.6 136.33 33.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.862 0.363 . . . . 1.0 110.931 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 74.47 5.59 73.37 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.907 -0.663 . . . . 1.0 112.83 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.5 120.68 16.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.702 0.287 . . . . 1.0 111.089 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HD2' ' CE2' ' A' ' 30' ' ' TYR . 3.4 ptp180 -70.27 120.82 16.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.362 . . . . 1.0 110.642 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.8 m -56.17 142.4 37.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.857 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.666 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -48.92 147.48 2.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.339 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 33.93 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.995 -0.548 . . . . 1.0 112.166 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -30.32 2.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.734 0.302 . . . . 1.0 111.136 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -178.58 70.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.881 0.372 . . . . 1.0 110.756 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.76 -85.66 1.72 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.718 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.666 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 55.7 Cg_endo -70.63 168.21 23.33 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.449 2.099 . . . . 1.0 112.39 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -99.32 -176.65 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.954 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 165.47 12.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.7 m -53.89 -175.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.038 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.26 88.52 7.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.988 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.21 -25.0 3.2 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.67 -0.776 . . . . 1.0 112.806 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -87.48 170.08 11.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.872 0.368 . . . . 1.0 111.055 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.454 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.7 m-85 -137.67 174.33 10.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.397 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 40.9 t -127.41 109.81 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 1.0 110.999 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -96.57 159.5 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.776 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.1 m -129.87 59.42 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 1.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.1 -169.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.079 -0.509 . . . . 1.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -63.23 82.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 1.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.52 144.83 0.41 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.843 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.6 54.93 5.42 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.631 2.221 . . . . 1.0 112.476 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE2' ' HD2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER 176.55 97.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 1.0 110.782 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.3 m -54.94 140.61 36.68 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.336 -0.393 . . . . 1.0 110.96 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.43 142.68 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.983 -179.687 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -110.85 124.4 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 1.0 110.477 179.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -149.19 171.52 16.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.028 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.501 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.7 t30 -51.26 170.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.206 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.454 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.63 -77.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 1.0 111.066 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 1.0 110.872 179.992 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.887 0.375 . . . . 1.0 110.917 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.4 m -91.85 143.42 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 1.0 111.386 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.19 -160.32 0.82 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.766 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 21' ' ' TYR . 1.2 m-20 -88.33 128.62 35.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.876 0.369 . . . . 1.0 111.076 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 84.89 -7.59 73.79 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.92 -0.657 . . . . 1.0 112.892 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -70.87 131.0 43.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.636 0.255 . . . . 1.0 111.145 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.814 ' CD ' ' CG ' ' A' ' 30' ' ' TYR . 45.3 mtm-85 -70.11 143.42 52.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.73 0.3 . . . . 1.0 110.582 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.7 m -73.54 151.61 40.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.414 -0.357 . . . . 1.0 110.231 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.17 148.05 0.65 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.578 -0.283 . . . . 1.0 111.385 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 36.26 -89.57 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.081 -0.508 . . . . 1.0 112.061 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.443 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.9 -35.17 2.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.74 0.305 . . . . 1.0 110.873 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p 179.63 70.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 1.0 110.722 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -96.57 -82.35 1.62 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.814 -0.708 . . . . 1.0 112.669 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.742 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 56.2 Cg_endo -70.5 166.1 29.63 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.439 2.093 . . . . 1.0 112.349 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.69 -174.48 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.9 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 166.88 10.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.84 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 97.0 m -52.6 -176.66 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 1.0 111.127 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.58 83.31 2.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.581 -0.736 . . . . 1.0 110.882 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 134.66 -25.47 3.41 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -87.32 170.57 11.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.844 0.354 . . . . 1.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.7 m-85 -138.64 177.68 7.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.615 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 12.9 t -124.43 111.02 15.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.98 -0.555 . . . . 1.0 110.881 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.0 172.04 7.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.704 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 m -147.27 68.55 1.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.344 -0.389 . . . . 1.0 110.773 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -58.15 -171.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.075 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -64.85 78.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER 175.31 128.52 0.13 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.687 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.39 73.65 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 1.0 112.349 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.814 ' CG ' ' CD ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 175.88 92.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.795 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.8 m -60.53 132.11 52.88 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.551 -0.295 . . . . 1.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -101.53 153.24 19.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.76 0.314 . . . . 1.0 111.138 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -122.3 123.61 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.308 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.77 174.42 15.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.332 -0.395 . . . . 1.0 111.185 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.502 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.0 t30 -44.55 167.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.656 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.65 -77.34 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.015 -0.539 . . . . 1.0 111.11 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.18 -0.914 . . . . 1.0 110.94 -179.95 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.2 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.882 0.372 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.7 m -115.94 143.41 25.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.905 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.408 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 170.54 -158.79 30.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.441 -0.885 . . . . 1.0 112.895 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 55.26 58.84 4.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.387 . . . . 1.0 111.156 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.65 3.71 73.5 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.928 -0.654 . . . . 1.0 112.977 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.52 131.05 43.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 1.0 111.213 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.39 124.28 23.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.689 179.509 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -60.19 137.95 58.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.563 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.716 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.46 146.71 1.96 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.404 . . . . 1.0 111.302 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t 34.78 -88.95 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.089 -0.505 . . . . 1.0 112.048 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.47 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.92 -36.08 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.745 0.307 . . . . 1.0 110.931 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 p -179.31 71.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 1.0 110.72 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -101.02 -85.69 1.88 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.858 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.716 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 31.6 Cg_exo -58.07 165.54 6.78 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.365 2.044 . . . . 1.0 112.392 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -100.12 146.85 26.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.651 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.8 158.95 30.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.893 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.9 m -54.14 -176.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.077 0.465 . . . . 1.0 110.961 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -85.45 107.21 17.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.027 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.51 -26.31 7.36 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.739 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.512 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.65 170.18 9.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 1.0 110.938 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.47 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.2 m-85 -136.76 178.79 6.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.684 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -123.31 118.69 28.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.825 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.06 129.32 46.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.846 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.9 m -106.34 47.48 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 1.0 110.821 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -57.91 -166.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.942 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -62.72 81.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 1.0 111.014 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.2 126.38 0.25 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 1.0 110.734 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.95 -27.31 44.2 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.416 2.077 . . . . 1.0 112.281 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.02 95.42 5.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.951 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.5 m -55.74 149.32 14.65 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.836 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 16.6 mtt85 -107.03 160.78 15.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.953 0.406 . . . . 1.0 111.136 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -131.6 127.78 37.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.196 179.646 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.29 174.47 14.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.741 0.305 . . . . 1.0 111.127 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.512 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.3 t-20 -43.07 165.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.57 -76.41 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.971 -0.559 . . . . 1.0 111.109 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.254 -0.879 . . . . 1.0 110.906 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.6 p . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.894 0.378 . . . . 1.0 110.885 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.11 148.63 4.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.296 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.73 -160.21 19.8 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.807 -0.711 . . . . 1.0 112.645 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -81.6 138.44 35.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.364 . . . . 1.0 111.031 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.42 9.93 59.09 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.956 -0.64 . . . . 1.0 112.814 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.47 127.64 33.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.682 0.277 . . . . 1.0 111.306 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.16 111.37 5.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.387 -0.37 . . . . 1.0 110.516 179.372 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 24.6 m -52.75 138.95 27.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.854 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.826 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.78 147.15 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.466 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 33.84 -89.2 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.121 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.46 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.83 -34.73 1.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.677 0.275 . . . . 1.0 110.96 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 p -177.7 70.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.404 . . . . 1.0 110.844 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.01 -81.3 1.58 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.751 -0.738 . . . . 1.0 112.749 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.826 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 51.5 Cg_endo -69.41 168.19 21.81 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.447 2.098 . . . . 1.0 112.46 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -97.4 -168.3 1.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.75 166.38 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.982 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 88.9 m -53.16 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.046 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -81.96 83.85 7.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.71 -0.677 . . . . 1.0 110.866 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.76 -26.61 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.613 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.511 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.05 170.16 10.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 1.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.473 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.5 m-85 -138.57 173.82 11.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.402 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.79 113.83 26.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.291 -0.413 . . . . 1.0 110.772 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.1 164.46 12.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.694 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.4 m -150.9 65.73 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.034 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -66.72 -163.95 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.66 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -63.44 80.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 1.0 110.911 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.37 155.04 5.98 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.824 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.55 -37.2 3.27 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.206 . . . . 1.0 112.415 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.17 122.82 40.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.047 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 36.7 m -72.01 162.65 29.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.391 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.77 172.47 11.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.087 0.47 . . . . 1.0 111.517 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.414 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -135.3 128.43 31.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.297 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -147.74 171.18 16.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.767 0.318 . . . . 1.0 111.065 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.511 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.6 t30 -50.5 170.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 1.0 111.257 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.473 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.65 -76.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.062 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.2 -0.905 . . . . 1.0 110.905 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.841 0.353 . . . . 1.0 110.9 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.4 m -91.94 144.14 9.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.084 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.71 -160.32 13.45 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.766 -0.731 . . . . 1.0 112.663 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.93 138.8 33.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.79 0.328 . . . . 1.0 110.963 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.68 3.07 71.73 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.863 -0.684 . . . . 1.0 112.933 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.35 120.12 15.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.725 0.297 . . . . 1.0 111.112 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HG2' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.1 106.57 3.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.599 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 96.3 m -48.06 133.96 14.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.314 -0.403 . . . . 1.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.452 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -42.84 144.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.87 -90.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.931 -0.577 . . . . 1.0 112.117 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.58 -25.85 3.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.633 0.254 . . . . 1.0 111.238 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 p 178.92 71.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.856 0.36 . . . . 1.0 110.905 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.01 -95.72 1.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.631 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.452 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.9 Cg_exo -53.18 164.3 1.88 Allowed 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.311 2.008 . . . . 1.0 112.444 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -107.08 149.41 27.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.439 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -71.54 160.27 33.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.86 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.74 -176.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.978 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -77.02 84.25 3.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.911 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 139.27 -27.07 2.66 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.754 -0.736 . . . . 1.0 112.607 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.476 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.2 m-30 -88.07 173.3 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.847 0.356 . . . . 1.0 110.943 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.48 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 24.5 m-85 -141.68 179.2 6.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.419 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.0 t -125.83 114.17 18.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.811 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.89 154.01 17.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 1.0 110.948 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.15 57.53 1.39 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.874 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -175.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.9 82.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.958 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.78 145.15 0.46 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.812 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -79.69 54.74 5.33 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.691 2.261 . . . . 1.0 112.46 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CD1' ' HG2' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.85 89.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.777 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.8 m -55.03 144.41 23.59 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.918 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -111.24 158.01 19.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.953 0.406 . . . . 1.0 111.031 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.93 127.64 54.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.604 179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -152.54 171.66 17.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.855 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.476 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 29.6 t30 -47.09 170.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 1.0 111.361 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.48 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.6 -76.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.088 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.249 -0.882 . . . . 1.0 110.885 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.918 0.389 . . . . 1.0 110.946 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -132.77 143.44 39.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.971 -0.558 . . . . 1.0 110.935 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 178.34 -158.06 22.46 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.438 -0.887 . . . . 1.0 113.001 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 56.55 66.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.909 0.385 . . . . 1.0 111.147 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.27 -2.73 80.63 Favored Glycine 0 CA--C 1.52 0.347 0 C-N-CA 120.948 -0.644 . . . . 1.0 112.912 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.57 119.09 14.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.724 0.262 . . . . 1.0 111.182 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 2.7 ptp180 -70.26 119.19 14.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.946 0.403 . . . . 1.0 110.623 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.69 140.41 23.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.035 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -46.59 147.89 1.12 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.254 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.939 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.457 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.32 -24.41 3.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.635 0.255 . . . . 1.0 111.1 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 p 175.02 73.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.824 0.345 . . . . 1.0 110.708 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.73 -94.12 2.02 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.753 -0.737 . . . . 1.0 112.902 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 44.0 Cg_exo -55.98 161.21 8.86 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.357 2.038 . . . . 1.0 112.466 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -96.19 152.58 18.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.678 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.14 156.85 28.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 1.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 74.4 m -53.76 -176.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.105 0.479 . . . . 1.0 110.959 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.16 93.96 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.782 -0.645 . . . . 1.0 111.036 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.45 3.52 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.656 -0.783 . . . . 1.0 112.778 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.511 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.15 170.1 9.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 1.0 111.05 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.3 m-85 -137.3 179.12 6.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.372 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 t -126.24 113.76 17.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.455 . . . . 1.0 111.004 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.45 139.43 32.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.529 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.5 m -116.19 52.38 0.92 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.962 0.411 . . . . 1.0 111.006 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.8 ttm180 -58.46 -163.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.769 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.57 81.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.487 -0.324 . . . . 1.0 110.978 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 178.96 147.8 0.4 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.726 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.79 -34.67 6.56 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.548 2.165 . . . . 1.0 112.252 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.449 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -97.01 96.45 8.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.835 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.4 m -55.45 151.55 10.06 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.492 -0.322 . . . . 1.0 110.731 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -108.58 142.39 39.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.884 0.373 . . . . 1.0 111.115 -179.546 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.461 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -114.22 124.02 51.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.122 179.453 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.31 174.05 15.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.157 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.511 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.8 t30 -43.2 165.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.462 . . . . 1.0 111.675 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.56 -77.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.091 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.231 -0.89 . . . . 1.0 110.911 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.6 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.947 0.403 . . . . 1.0 110.946 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.88 149.16 26.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.894 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 167.59 -158.4 31.24 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.37 -0.919 . . . . 1.0 112.905 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 56.13 58.74 4.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.385 . . . . 1.0 111.216 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.23 -0.52 83.85 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.824 -0.703 . . . . 1.0 113.011 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.26 129.32 39.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.778 0.323 . . . . 1.0 111.264 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.49 122.9 20.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 1.0 110.585 179.541 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 7.5 m -55.54 141.22 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.496 -0.32 . . . . 1.0 110.614 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.658 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -49.24 145.16 4.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.363 -0.38 . . . . 1.0 111.216 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.85 -89.0 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.042 -0.526 . . . . 1.0 112.053 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.471 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -35.83 2.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.731 0.301 . . . . 1.0 111.01 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.7 p -179.57 71.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.889 0.376 . . . . 1.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.29 -87.48 1.93 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.739 -0.744 . . . . 1.0 112.735 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.658 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 38.6 Cg_exo -59.77 168.26 5.82 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.401 2.068 . . . . 1.0 112.36 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -105.12 147.11 28.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.634 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.64 158.06 36.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.863 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.7 m -53.84 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.107 0.48 . . . . 1.0 111.079 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -82.6 105.06 13.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.974 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.08 -25.94 6.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.652 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.02 170.53 9.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.788 0.328 . . . . 1.0 110.959 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -136.48 179.85 6.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.696 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.5 t -126.31 114.83 18.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -99.02 168.84 9.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.428 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.3 m -148.71 66.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.912 0.387 . . . . 1.0 111.189 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -162.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.55 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.8 m -67.21 66.95 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 5.2 mmt -159.98 135.46 5.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.729 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.17 -29.52 75.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.398 2.065 . . . . 1.0 112.432 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.21 119.72 36.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 1.0 111.126 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.3 m -71.84 151.01 43.77 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.291 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -110.44 154.91 22.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.858 0.361 . . . . 1.0 111.267 -179.282 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.441 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -131.1 127.54 38.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.068 -0.514 . . . . 1.0 110.1 179.406 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -162.29 173.78 13.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.747 0.308 . . . . 1.0 111.154 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.508 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 40.8 t30 -43.16 165.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.709 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.468 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.58 -76.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.096 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 1.0 110.926 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.85 0.357 . . . . 1.0 110.943 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -81.98 147.29 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.267 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.15 -160.11 7.98 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.85 -0.69 . . . . 1.0 112.623 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.98 138.76 33.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.863 0.363 . . . . 1.0 110.995 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.92 12.75 58.07 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.864 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.4 127.77 33.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 1.0 111.09 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.2 111.22 5.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.623 179.554 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' CE1' ' A' ' 30' ' ' TYR . 70.5 m -52.87 134.44 37.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.744 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.749 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -43.68 143.88 0.92 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.575 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.17 -90.13 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.945 -0.57 . . . . 1.0 112.151 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.445 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.39 -30.46 1.91 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.663 0.268 . . . . 1.0 111.262 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -178.71 70.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.819 0.342 . . . . 1.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.65 -84.0 1.75 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.755 -0.736 . . . . 1.0 112.743 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.749 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.6 Cg_endo -71.61 168.56 23.3 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.472 2.115 . . . . 1.0 112.443 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -97.51 -170.8 2.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.964 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.464 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.1 OUTLIER -115.55 165.75 12.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.883 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.6 m -53.51 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 1.0 111.059 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.84 84.22 7.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.877 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.01 -26.6 2.6 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.703 -0.761 . . . . 1.0 112.594 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.507 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.7 m-30 -90.38 169.82 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.34 . . . . 1.0 110.939 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.2 m-85 -137.2 174.17 10.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.432 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 51.8 t -113.29 113.21 24.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.312 -0.403 . . . . 1.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 t -94.16 167.47 11.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 1.0 110.665 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 62.8 m -150.62 63.86 0.94 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.956 0.408 . . . . 1.0 111.085 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -63.31 -163.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.604 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.17 81.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 1.0 110.871 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.28 149.69 0.68 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.848 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.95 -36.68 7.29 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 1.0 112.371 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.451 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER -90.19 112.21 23.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.932 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.01 162.16 22.7 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.555 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -126.29 170.22 12.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.009 0.433 . . . . 1.0 111.387 -179.634 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.06 129.53 34.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.796 -0.638 . . . . 1.0 110.409 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -151.13 169.97 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 1.0 110.976 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.507 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.9 t30 -49.09 170.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 1.0 111.276 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.67 -76.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.999 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.4 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.174 -0.917 . . . . 1.0 110.877 -179.98 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HB2' ' N ' ' A' ' 18' ' ' CYS . 27.9 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.945 0.402 . . . . 1.0 110.983 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.51 HG12 ' CG ' ' A' ' 7' ' ' GLN . 0.1 OUTLIER -93.25 164.76 2.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.096 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.71 -160.71 32.45 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.859 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -88.19 132.48 34.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.891 0.377 . . . . 1.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.39 6.96 59.59 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.961 -0.637 . . . . 1.0 112.826 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.51 ' CG ' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.97 129.48 39.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.584 0.231 . . . . 1.0 111.23 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.37 112.22 6.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.969 0.414 . . . . 1.0 110.562 179.507 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 19.2 m -50.51 139.84 15.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.312 -0.404 . . . . 1.0 110.856 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.31 145.84 0.76 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.404 -0.362 . . . . 1.0 111.314 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 35.49 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.729 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.462 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -142.48 5.03 1.6 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.473 0.175 . . . . 1.0 111.473 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 12' ' ' TRP . 1.7 p 163.31 77.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.717 0.294 . . . . 1.0 110.558 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.66 -100.06 2.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.602 -0.809 . . . . 1.0 113.063 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.455 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.5 Cg_exo -53.15 165.95 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.426 2.084 . . . . 1.0 112.705 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -108.94 149.39 29.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 1.0 110.618 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.09 157.35 38.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 1.0 111.026 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 21' ' ' TYR . 76.1 m -62.45 -176.62 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.914 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.43 94.04 2.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.98 -9.24 7.12 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.739 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 21' ' ' TYR . 2.0 m-85 -110.62 170.75 7.89 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.749 0.309 . . . . 1.0 110.775 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 36' ' ' ASN . 18.5 m-85 -142.44 173.64 11.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.266 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.4 t -117.35 114.43 23.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.25 -0.432 . . . . 1.0 111.188 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -95.77 169.47 9.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.37 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 85.3 m -151.32 70.29 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 1.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -62.12 -164.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.635 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -69.5 65.06 0.18 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.903 0.382 . . . . 1.0 111.159 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 9.1 mmt -155.83 157.12 31.3 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.788 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.48 -45.52 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.514 2.142 . . . . 1.0 112.378 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.54 107.57 16.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 1.0 110.857 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 9' ' ' CYS . 35.6 m -61.21 167.6 3.03 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.253 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -128.21 164.25 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.085 0.469 . . . . 1.0 111.795 -179.413 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.443 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.21 124.96 23.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.189 179.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -145.21 172.68 12.78 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.831 0.348 . . . . 1.0 111.096 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.451 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 19.3 t30 -50.97 171.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.923 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HA ' ' CD2' ' A' ' 22' ' ' TYR . 1.4 p30 -69.9 -77.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.985 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.194 -0.908 . . . . 1.0 110.887 -179.938 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.9 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.886 0.374 . . . . 1.0 110.93 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.3 m -92.63 145.27 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 1.0 111.129 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.05 -160.95 8.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.811 -0.709 . . . . 1.0 112.715 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.71 135.0 33.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 1.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.01 0.87 77.6 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 1.0 112.772 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.45 128.39 36.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.726 0.298 . . . . 1.0 111.229 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.32 115.5 9.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 1.0 110.556 179.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 64.1 m -55.77 135.65 51.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.436 -0.347 . . . . 1.0 110.561 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.55 146.44 0.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.543 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.38 -90.03 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.042 -0.527 . . . . 1.0 111.986 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.65 -23.75 3.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.599 0.238 . . . . 1.0 111.305 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p 177.36 72.54 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.885 0.374 . . . . 1.0 110.764 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.19 -94.24 2.06 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.822 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.534 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 51.3 Cg_exo -53.48 165.1 1.73 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.353 2.035 . . . . 1.0 112.574 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -108.49 149.44 28.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.653 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 157.22 38.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -57.28 -176.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.088 0.47 . . . . 1.0 110.957 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -75.68 87.47 2.74 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 135.75 -27.31 3.08 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.33 170.45 9.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.723 0.297 . . . . 1.0 110.783 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.491 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.1 m-85 -139.71 173.59 11.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.572 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.2 t -111.43 112.99 25.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.687 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.94 166.03 12.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.695 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.5 m -151.22 66.42 0.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.985 0.422 . . . . 1.0 110.993 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -68.17 -163.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.663 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -63.83 79.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.1 141.07 0.42 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.778 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.02 -62.68 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.469 2.112 . . . . 1.0 112.294 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.88 115.02 6.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.999 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.1 m -69.6 169.32 12.93 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.326 -0.397 . . . . 1.0 110.329 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.1 170.02 14.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.07 0.462 . . . . 1.0 111.467 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.419 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -139.43 126.89 21.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.394 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.27 173.34 15.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 1.0 111.054 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 33.3 t30 -47.51 170.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.406 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.491 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.2 p30 -69.54 -76.43 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 1.0 111.042 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.925 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.792 0.33 . . . . 1.0 110.904 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 m -111.83 162.96 9.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.058 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.16 -160.32 31.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.645 -0.788 . . . . 1.0 112.595 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 53.13 63.75 2.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.883 0.373 . . . . 1.0 111.074 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.39 2.02 83.08 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.901 -0.666 . . . . 1.0 112.871 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -70.34 123.2 21.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.736 0.303 . . . . 1.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.18 122.78 20.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.814 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 79.8 m -59.62 142.11 53.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.521 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.71 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.18 140.6 3.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.371 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.21 -90.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.005 -0.543 . . . . 1.0 112.098 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.81 -29.74 2.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.697 0.284 . . . . 1.0 111.129 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p 178.23 72.14 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 1.0 110.771 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.45 -91.58 1.57 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.701 -0.762 . . . . 1.0 112.74 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.71 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 71.9 Cg_endo -75.19 168.53 24.5 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.471 2.114 . . . . 1.0 112.466 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -81.62 -170.49 2.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.38 165.79 20.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.505 . . . . 1.0 110.796 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.8 m -53.68 -176.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.99 -0.55 . . . . 1.0 111.045 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -93.59 124.75 37.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.749 -0.659 . . . . 1.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.85 -27.69 14.11 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.709 -0.757 . . . . 1.0 112.623 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.67 170.32 9.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.838 0.351 . . . . 1.0 110.933 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 16.3 m-85 -135.82 177.19 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.053 -0.522 . . . . 1.0 110.411 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.7 t -127.67 110.69 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.973 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -99.2 170.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.68 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.6 m -142.17 65.75 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -60.08 -168.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.91 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 m -64.99 78.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.034 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.432 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER 179.71 129.74 0.24 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.725 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 18.9 Cg_exo -66.26 63.76 0.49 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.527 2.152 . . . . 1.0 112.307 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 177.13 94.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.861 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -56.97 136.36 56.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.782 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.97 142.64 34.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.94 0.4 . . . . 1.0 111.095 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -109.11 124.97 51.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.422 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -153.04 170.83 19.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.446 -0.343 . . . . 1.0 111.014 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.3 t30 -46.39 168.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.332 -0.394 . . . . 1.0 111.454 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.72 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 1.0 111.077 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.272 -0.87 . . . . 1.0 110.896 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.897 0.379 . . . . 1.0 110.969 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.469 HG12 ' OE1' ' A' ' 7' ' ' GLN . 6.1 m -116.62 163.87 13.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 1.0 111.037 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.17 -160.25 31.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.676 -0.773 . . . . 1.0 112.67 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 t70 53.59 66.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 1.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.05 -2.09 82.31 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.963 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.469 ' OE1' HG12 ' A' ' 3' ' ' VAL . 0.4 OUTLIER -70.59 116.62 11.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.652 0.263 . . . . 1.0 111.117 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.3 118.51 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.888 0.375 . . . . 1.0 110.879 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 88.0 m -51.23 138.92 19.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.93 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.729 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.46 146.04 0.76 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.482 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.4 t 34.8 -90.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.963 -0.562 . . . . 1.0 112.032 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.456 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.88 -30.58 2.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 1.0 111.034 179.764 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.1 p -179.44 71.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.858 0.361 . . . . 1.0 110.641 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.52 -91.01 1.75 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.757 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.729 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 58.9 Cg_endo -72.17 168.25 24.6 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.442 2.094 . . . . 1.0 112.478 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -87.26 -175.06 5.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.84 164.92 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.868 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.8 m -54.1 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.01 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -93.5 118.46 31.37 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.668 -0.697 . . . . 1.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 115.16 -27.43 8.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.708 -0.758 . . . . 1.0 112.636 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.506 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.51 170.2 9.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.897 0.379 . . . . 1.0 110.892 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 15.0 m-85 -135.77 176.24 8.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.239 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 t -127.65 109.19 11.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.34 151.07 21.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 1.0 110.448 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.51 56.56 1.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 1.0 111.088 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -59.48 -175.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.839 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -61.28 85.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 1.0 111.006 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.35 145.12 0.43 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.862 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.02 54.34 5.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.67 2.247 . . . . 1.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 174.41 92.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.64 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.75 144.46 14.19 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.454 -0.339 . . . . 1.0 110.764 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.58 141.97 35.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.35 . . . . 1.0 111.023 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -114.09 122.22 46.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.219 179.431 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.66 172.02 16.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.291 -0.413 . . . . 1.0 111.125 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.506 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.8 t30 -46.0 168.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.455 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.59 -76.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.085 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 1.0 110.887 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.801 0.334 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.9 m -112.97 163.04 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.947 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.97 -160.02 30.06 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.573 -0.822 . . . . 1.0 112.738 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.58 52.5 12.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.872 0.368 . . . . 1.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.11 -0.16 83.62 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.858 -0.686 . . . . 1.0 112.949 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.29 126.46 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.74 0.305 . . . . 1.0 111.02 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 1.5 mpp_? -70.15 124.85 25.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.37 . . . . 1.0 110.835 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.9 m -57.97 138.97 55.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.268 -0.423 . . . . 1.0 110.605 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.875 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.38 143.62 1.73 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.393 . . . . 1.0 111.449 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.3 t 35.43 -89.31 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.985 -0.552 . . . . 1.0 112.128 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.461 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.15 -38.76 1.59 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.718 0.294 . . . . 1.0 110.802 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.3 p -177.12 69.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 1.0 110.787 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.06 -81.26 1.59 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.728 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.875 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 61.4 Cg_endo -73.39 167.76 26.47 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.451 2.1 . . . . 1.0 112.44 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -89.05 -171.64 3.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.03 164.39 20.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.815 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.8 m -54.16 -176.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.157 0.503 . . . . 1.0 110.932 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -90.88 122.54 33.67 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 1.0 111.083 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.98 -26.3 17.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 1.0 112.661 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.4 m-30 -95.66 170.72 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.825 0.345 . . . . 1.0 111.059 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.465 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.5 m-85 -135.85 178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.595 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.4 t -127.53 105.94 8.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.974 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.48 170.27 10.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.704 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 m -147.18 68.27 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.318 -0.401 . . . . 1.0 110.881 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm-85 -62.04 -171.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.95 80.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.991 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.09 144.04 0.49 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.859 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.16 58.21 6.12 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.619 2.212 . . . . 1.0 112.449 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.78 97.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.844 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -58.98 147.17 35.43 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.706 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 1.0 111.087 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.02 125.55 54.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.327 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 173.23 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.134 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.5 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 39.5 t30 -45.0 167.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.501 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.465 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.72 -76.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.045 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.22 -0.895 . . . . 1.0 110.928 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.847 0.356 . . . . 1.0 110.941 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.417 HG12 ' NE2' ' A' ' 7' ' ' GLN . 6.0 m -99.46 143.39 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 1.0 110.854 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.29 174.05 44.22 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.45 -0.881 . . . . 1.0 113.032 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.27 75.21 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.874 0.369 . . . . 1.0 111.349 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 72.07 6.4 64.3 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.006 -0.616 . . . . 1.0 113.211 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' NE2' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.54 118.95 13.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.934 0.367 . . . . 1.0 111.215 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.18 109.52 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.661 179.581 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.73 139.72 12.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.383 -0.371 . . . . 1.0 110.902 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.774 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.51 141.29 2.78 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.59 -89.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.973 -0.558 . . . . 1.0 112.201 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.454 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.23 -36.42 2.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.722 0.296 . . . . 1.0 110.983 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -178.67 70.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.11 -91.05 1.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 1.0 112.647 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.774 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.58 168.33 23.93 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.467 2.111 . . . . 1.0 112.397 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -78.12 -175.32 4.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 t -117.67 165.25 13.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 66.1 m -53.62 -176.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 1.0 111.056 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -94.44 118.03 31.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.057 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.16 -29.47 9.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.583 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.52 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.3 m-30 -97.33 169.81 9.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.777 0.322 . . . . 1.0 110.831 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.2 m-85 -133.39 175.31 9.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 1.0 110.396 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.3 t -119.12 112.68 19.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.001 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -95.93 151.19 19.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.811 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.0 m -127.08 57.73 1.46 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 1.0 110.962 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -61.63 -171.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.834 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -62.81 83.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.056 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.93 143.53 0.49 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.806 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.77 53.42 4.77 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.709 2.273 . . . . 1.0 112.576 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER 177.33 90.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 1.0 110.82 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.2 m -55.26 142.76 30.43 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.889 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -112.77 153.79 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.947 0.403 . . . . 1.0 111.134 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -112.31 125.22 53.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.556 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -146.37 166.46 26.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.52 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.2 t30 -45.69 168.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 1.0 111.486 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.71 -77.02 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 1.0 111.073 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.29 -0.862 . . . . 1.0 110.921 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.865 0.364 . . . . 1.0 110.917 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.1 m -121.92 162.51 21.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.071 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 161.52 -159.12 30.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.598 -0.811 . . . . 1.0 112.851 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 t70 55.23 60.43 3.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 1.0 111.241 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.1 -0.58 83.13 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.826 -0.702 . . . . 1.0 112.955 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -70.25 133.61 47.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 1.0 111.25 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.43 124.7 24.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.687 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -58.19 144.56 40.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.542 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.863 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -51.81 141.23 17.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.49 -0.323 . . . . 1.0 111.048 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 35.42 -88.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.073 -0.512 . . . . 1.0 112.101 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.474 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.45 -39.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.75 0.31 . . . . 1.0 110.883 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 p -178.22 70.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.721 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.92 -81.81 1.62 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.702 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.863 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 60.6 Cg_endo -73.21 168.25 25.22 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 122.347 2.032 . . . . 1.0 112.379 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -96.78 159.83 14.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.58 164.65 15.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -53.79 -176.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.96 113.93 22.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.976 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 113.31 -26.51 10.27 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.743 -0.741 . . . . 1.0 112.629 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.5 m-30 -95.48 170.89 9.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 1.0 111.023 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 22.0 m-85 -136.49 -179.3 5.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.683 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.9 t -126.02 119.05 26.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.948 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.2 m -101.48 166.91 10.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.492 . . . . 1.0 110.42 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.1 m -149.08 53.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.895 0.379 . . . . 1.0 111.065 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.55 -163.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 1.0 110.568 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -60.19 83.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.839 0.352 . . . . 1.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.417 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.1 OUTLIER -177.85 131.21 0.32 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.71 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 48.7 Cg_exo -55.96 -26.53 59.12 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 1.0 112.518 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.67 125.44 48.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.417 -0.356 . . . . 1.0 111.211 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.44 146.02 43.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.203 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 24' ' ' SER . 0.1 OUTLIER -108.12 160.85 15.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 1.0 111.436 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.408 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.36 130.43 32.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.189 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -164.13 173.71 12.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.771 0.319 . . . . 1.0 111.013 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.494 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 21.6 t30 -43.07 164.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.582 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.69 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.043 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.259 -0.876 . . . . 1.0 110.895 -179.952 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.875 0.369 . . . . 1.0 110.904 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -85.45 149.5 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.231 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.16 -160.22 17.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 1.0 112.568 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.41 133.07 33.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.356 . . . . 1.0 110.959 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.06 -1.79 83.46 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.794 -0.717 . . . . 1.0 112.928 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.36 126.26 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.732 0.301 . . . . 1.0 111.144 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.11 121.49 17.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.792 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -59.02 142.37 51.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.762 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.645 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.85 142.38 3.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.422 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.013 -0.539 . . . . 1.0 112.19 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.29 -31.36 3.06 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 1.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -179.03 70.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.833 0.349 . . . . 1.0 110.851 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -92.95 -86.46 1.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.694 -0.765 . . . . 1.0 112.629 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.645 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 63.4 Cg_endo -74.09 168.21 25.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.415 2.077 . . . . 1.0 112.378 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -99.28 173.1 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -94.81 165.3 12.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.911 179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 84.4 m -53.95 -176.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.988 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.12 84.23 5.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.691 -0.686 . . . . 1.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.77 -25.8 2.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.672 -0.775 . . . . 1.0 112.674 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 4.1 m-30 -87.51 171.68 10.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.853 0.359 . . . . 1.0 110.98 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.456 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -138.54 178.97 6.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.0 110.589 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.6 t -129.76 114.83 16.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -102.7 173.92 6.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 1.0 110.959 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.5 m -145.13 66.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.868 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.46 -167.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.833 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -65.11 78.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.966 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.47 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER -179.83 128.49 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.732 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 20.2 Cg_exo -65.72 64.09 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.54 2.16 . . . . 1.0 112.334 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.441 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.79 94.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.796 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.6 m -57.21 134.68 56.13 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.946 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -103.31 153.65 20.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 1.0 111.005 -179.621 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.3 128.42 54.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.448 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.48 172.23 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.032 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.475 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 35.0 t30 -46.74 169.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.0 111.447 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.6 p30 -69.72 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.077 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.209 -0.9 . . . . 1.0 110.91 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.82 0.343 . . . . 1.0 111.011 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p -112.63 164.01 13.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.433 HG23 ' SG ' ' A' ' 17' ' ' CYS . 13.5 m -84.26 142.83 12.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.181 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.13 -160.36 1.63 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 1.0 112.581 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.63 128.22 36.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.881 0.372 . . . . 1.0 110.961 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 86.89 -7.87 78.38 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.922 -0.656 . . . . 1.0 112.84 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.52 126.4 29.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.618 0.247 . . . . 1.0 110.907 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.606 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 43.2 mtt85 -70.32 144.62 51.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 1.0 111.11 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -72.88 136.69 45.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.909 -0.587 . . . . 1.0 110.529 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.771 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -38.16 149.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.293 -0.412 . . . . 1.0 111.772 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.1 t 37.17 -91.31 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.01 -0.541 . . . . 1.0 112.163 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.423 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.76 -29.62 1.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.626 0.25 . . . . 1.0 111.156 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 60.8 p -179.52 71.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.782 0.325 . . . . 1.0 110.747 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.57 -84.57 1.8 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.761 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.771 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 39.7 Cg_endo -67.37 168.73 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.442 2.095 . . . . 1.0 112.479 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -101.37 -173.35 2.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.957 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.433 ' SG ' HG23 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -109.76 166.17 11.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.809 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 73.4 m -53.39 -176.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 1.0 111.055 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -80.04 85.61 5.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.973 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.16 -25.63 3.16 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.663 -0.78 . . . . 1.0 112.713 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -85.57 170.21 12.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.903 0.382 . . . . 1.0 110.986 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 17.1 m-85 -137.82 176.85 8.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.985 -0.552 . . . . 1.0 110.358 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 19.1 t -126.66 108.21 10.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 1.0 111.009 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.99 166.43 15.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.366 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.7 m -150.17 64.37 0.96 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.939 0.4 . . . . 1.0 111.253 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.439 ' O ' ' N ' ' A' ' 28' ' ' MET . 0.7 OUTLIER -61.49 -162.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.403 179.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.14 75.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.439 -0.346 . . . . 1.0 110.925 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 178.72 149.62 0.42 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.625 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.34 -45.71 0.79 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.52 2.147 . . . . 1.0 112.415 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.606 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER -71.03 95.4 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.803 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.7 m -62.85 155.22 27.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.683 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.543 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -111.15 142.59 43.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.746 0.307 . . . . 1.0 110.962 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -119.84 123.73 44.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.203 179.484 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.96 174.19 15.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.156 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.1 t30 -45.95 168.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.425 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.68 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.112 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -154.4 127.42 8.29 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 118.242 -0.885 . . . . 1.0 110.886 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.78 0 O-C-N 123.54 0.525 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.788 0.328 . . . . 1.0 111.068 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.1 p -129.03 164.51 23.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.958 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.5 m -86.89 154.27 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.063 -0.517 . . . . 1.0 111.258 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.51 -160.39 31.6 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.799 -0.715 . . . . 1.0 112.562 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.06 133.69 34.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.871 0.367 . . . . 1.0 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.19 -1.11 81.96 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.89 -0.671 . . . . 1.0 112.813 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.39 124.57 24.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.73 0.3 . . . . 1.0 111.218 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.08 115.36 9.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 1.0 110.688 179.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.1 m -53.26 144.66 15.57 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.887 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.09 137.93 7.26 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.317 -0.401 . . . . 1.0 111.355 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.4 t 36.74 -90.83 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.988 -0.551 . . . . 1.0 112.177 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.432 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -123.3 -29.14 3.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.672 0.272 . . . . 1.0 111.172 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.23 71.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.876 0.369 . . . . 1.0 110.874 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.28 -88.49 1.41 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.774 -0.727 . . . . 1.0 112.589 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.561 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 74.0 Cg_endo -75.57 168.43 24.44 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.424 2.083 . . . . 1.0 112.377 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -97.37 175.5 6.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.926 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.78 165.35 12.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.852 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 85.7 m -53.63 -176.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.99 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.76 84.17 4.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.703 -0.681 . . . . 1.0 110.954 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.26 -28.16 2.71 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.667 -0.778 . . . . 1.0 112.597 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 6.0 m-30 -83.77 174.04 10.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 1.0 110.939 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.478 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 26.2 m-85 -142.84 179.94 6.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 1.0 110.484 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -131.4 119.41 21.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.837 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -107.08 164.81 11.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.039 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.4 m -132.39 60.94 1.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttm-85 -56.19 -170.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.043 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -64.27 78.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.125 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.01 141.59 0.29 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.798 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.8 58.85 6.16 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.532 2.155 . . . . 1.0 112.415 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -178.85 89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.888 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.0 m -55.26 132.69 48.41 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.935 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.404 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -100.66 154.96 18.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.096 -179.534 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.413 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.74 126.61 52.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.304 179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -153.88 172.42 17.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.481 -0.327 . . . . 1.0 111.039 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.465 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 37.1 t30 -46.41 169.88 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.458 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.478 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.61 -76.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.058 -0.519 . . . . 1.0 111.007 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -104.45 132.61 50.5 Favored 'General case' 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.871 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.802 0 O-C-N 123.54 0.525 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.839 0.352 . . . . 1.0 111.053 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.0 p -125.54 165.42 18.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.9 m -90.41 144.21 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.077 -0.51 . . . . 1.0 111.274 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.24 -160.17 2.21 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.854 -0.689 . . . . 1.0 112.811 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.97 128.83 35.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.837 0.351 . . . . 1.0 111.009 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 79.62 -1.57 77.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.84 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -70.55 136.11 49.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.793 0.33 . . . . 1.0 111.238 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 22.1 mmt-85 -70.41 130.7 42.62 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.308 -0.405 . . . . 1.0 110.647 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.8 m -64.72 146.31 54.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.233 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.817 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.94 144.9 1.07 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.611 -0.268 . . . . 1.0 111.288 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t 37.75 -92.09 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.138 -0.483 . . . . 1.0 112.018 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.409 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.83 -28.46 2.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.613 0.244 . . . . 1.0 111.141 179.735 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p 175.48 73.24 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 1.0 110.769 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.82 -82.32 1.6 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.777 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.817 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.97 168.66 23.31 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.457 2.105 . . . . 1.0 112.421 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -96.73 -172.38 2.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.82 166.87 10.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 72.6 m -52.58 -176.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.112 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -74.9 84.2 2.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.931 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.78 -26.92 3.56 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.648 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -84.96 170.45 13.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.821 0.343 . . . . 1.0 110.854 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 14.8 m-85 -140.19 174.52 10.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.484 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 30.6 t -115.2 118.02 32.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.691 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.5 m -101.04 166.04 11.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.688 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.0 m -149.41 59.52 1.02 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.925 0.393 . . . . 1.0 111.107 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 28' ' ' MET . 2.8 ttm180 -59.35 -163.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.64 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.3 m -61.32 81.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 1.0 110.919 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER 179.21 148.62 0.43 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.682 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -74.55 -22.35 15.97 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.576 2.184 . . . . 1.0 112.529 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -94.93 104.45 16.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.125 -179.816 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 30.6 m -64.76 143.85 57.65 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.391 -0.368 . . . . 1.0 110.116 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -110.76 168.91 9.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.086 0.469 . . . . 1.0 111.682 -179.239 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -140.1 125.59 19.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.615 -0.721 . . . . 1.0 110.175 179.651 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -153.63 174.2 14.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.908 0.385 . . . . 1.0 111.163 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.6 t30 -46.14 169.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.518 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.489 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.3 p30 -69.59 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 1.0 111.103 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.0 t -146.65 138.75 24.79 Favored 'General case' 0 C--O 1.249 1.036 0 CA-C-O 118.256 -0.878 . . . . 1.0 110.875 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.737 0 O-C-N 123.528 0.518 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.86 0.362 . . . . 1.0 111.11 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.7 p -107.61 165.25 11.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.9 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.443 HG22 ' HA ' ' A' ' 17' ' ' CYS . 19.4 m -92.66 142.94 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.506 . . . . 1.0 111.152 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.53 -160.25 7.31 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.787 -0.721 . . . . 1.0 112.782 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.05 137.12 33.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.815 0.34 . . . . 1.0 110.931 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 76.46 3.23 77.21 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.852 -0.689 . . . . 1.0 112.859 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.38 122.73 20.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.71 0.29 . . . . 1.0 111.109 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.607 ' HG2' ' CG ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -69.95 107.82 3.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.58 179.62 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.9 m -48.14 134.77 13.87 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.781 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.4 147.93 0.52 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.375 -0.375 . . . . 1.0 111.361 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.99 -89.56 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.02 -0.536 . . . . 1.0 112.055 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.464 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.04 -31.87 3.07 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.623 0.249 . . . . 1.0 111.088 179.724 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.2 p -178.25 70.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.909 0.385 . . . . 1.0 110.88 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.59 -89.86 1.76 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.883 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.549 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 52.6 Cg_exo -54.43 156.4 14.13 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.461 2.107 . . . . 1.0 112.54 -179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -101.75 146.37 27.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.656 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.443 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -68.56 161.63 27.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.346 -0.388 . . . . 1.0 111.005 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.53 -176.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.098 0.475 . . . . 1.0 110.992 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.73 85.27 2.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.861 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.56 -28.13 2.9 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.533 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.6 m-30 -85.41 173.79 10.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.862 0.363 . . . . 1.0 110.956 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.475 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 28.7 m-85 -145.08 179.11 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.995 -0.548 . . . . 1.0 110.376 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 38.7 t -120.46 116.33 25.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.582 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.91 162.94 13.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.053 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 39.2 m -150.02 69.9 1.03 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.735 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 ttm-85 -71.21 63.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.201 -0.454 . . . . 1.0 111.044 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m 48.97 81.6 0.05 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.254 -0.43 . . . . 1.0 111.256 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -156.48 169.54 10.35 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.905 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -92.05 25.52 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.123 2.548 . . . . 1.0 112.458 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.607 ' CG ' ' HG2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -174.55 93.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.588 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.4 m -56.02 153.04 9.41 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.005 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 3.2 ptt85 -115.77 161.4 18.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.975 0.417 . . . . 1.0 111.216 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 126.43 44.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.0 110.428 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.2 173.4 15.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.94 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.486 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 47.1 t30 -45.85 168.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 1.0 111.494 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.475 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.2 p30 -69.7 -76.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.004 -0.544 . . . . 1.0 111.058 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.4 t -110.45 140.66 44.47 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-O 118.236 -0.888 . . . . 1.0 110.907 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.761 0 O-C-N 123.544 0.527 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.836 0.35 . . . . 1.0 111.03 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.6 p -109.46 164.48 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.962 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.6 m -84.74 148.46 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 1.0 111.217 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.59 -160.22 4.13 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.802 -0.714 . . . . 1.0 112.623 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.6 136.33 33.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.862 0.363 . . . . 1.0 110.931 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 74.47 5.59 73.37 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.907 -0.663 . . . . 1.0 112.83 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -70.5 120.68 16.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.702 0.287 . . . . 1.0 111.089 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HD2' ' CE2' ' A' ' 30' ' ' TYR . 3.4 ptp180 -70.27 120.82 16.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.859 0.362 . . . . 1.0 110.642 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 61.8 m -56.17 142.4 37.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.857 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.666 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -48.92 147.48 2.73 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.339 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 33.93 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.995 -0.548 . . . . 1.0 112.166 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -30.32 2.71 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.734 0.302 . . . . 1.0 111.136 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -178.58 70.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.881 0.372 . . . . 1.0 110.756 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.76 -85.66 1.72 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.718 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.666 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 55.7 Cg_endo -70.63 168.21 23.33 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.449 2.099 . . . . 1.0 112.39 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -99.32 -176.65 3.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.954 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -112.66 165.47 12.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 64.7 m -53.89 -175.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.038 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.26 88.52 7.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.988 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 136.21 -25.0 3.2 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.67 -0.776 . . . . 1.0 112.806 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -87.48 170.08 11.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.872 0.368 . . . . 1.0 111.055 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.454 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.7 m-85 -137.67 174.33 10.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 1.0 110.397 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 40.9 t -127.41 109.81 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.324 -0.398 . . . . 1.0 110.999 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.5 m -96.57 159.5 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.776 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.1 m -129.87 59.42 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 1.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.1 -169.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.079 -0.509 . . . . 1.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -63.23 82.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.449 . . . . 1.0 110.994 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.52 144.83 0.41 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.843 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -79.6 54.93 5.42 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.631 2.221 . . . . 1.0 112.476 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.445 ' CE2' ' HD2' ' A' ' 8' ' ' ARG . 0.1 OUTLIER 176.55 97.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 1.0 110.782 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.3 m -54.94 140.61 36.68 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.336 -0.393 . . . . 1.0 110.96 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.43 142.68 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.983 -179.687 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -110.85 124.4 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 1.0 110.477 179.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -149.19 171.52 16.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.028 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.501 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.7 t30 -51.26 170.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.206 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.454 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.63 -77.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 1.0 111.066 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.6 t -117.36 128.24 54.84 Favored 'General case' 0 C--O 1.249 1.074 0 CA-C-O 118.264 -0.874 . . . . 1.0 110.872 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.785 0 O-C-N 123.513 0.508 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.847 0.356 . . . . 1.0 111.072 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.1 p -82.81 164.81 20.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.4 m -91.85 143.42 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 1.0 111.386 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.19 -160.32 0.82 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.766 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 21' ' ' TYR . 1.2 m-20 -88.33 128.62 35.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.876 0.369 . . . . 1.0 111.076 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 84.89 -7.59 73.79 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.92 -0.657 . . . . 1.0 112.892 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.8 tp60 -70.87 131.0 43.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.636 0.255 . . . . 1.0 111.145 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.814 ' CD ' ' CG ' ' A' ' 30' ' ' TYR . 45.3 mtm-85 -70.11 143.42 52.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.73 0.3 . . . . 1.0 110.582 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.7 m -73.54 151.61 40.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.414 -0.357 . . . . 1.0 110.231 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.742 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.17 148.05 0.65 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.578 -0.283 . . . . 1.0 111.385 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 36.26 -89.57 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.081 -0.508 . . . . 1.0 112.061 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.443 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.9 -35.17 2.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.74 0.305 . . . . 1.0 110.873 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 p 179.63 70.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 1.0 110.722 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -96.57 -82.35 1.62 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.814 -0.708 . . . . 1.0 112.669 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.742 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 56.2 Cg_endo -70.5 166.1 29.63 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.439 2.093 . . . . 1.0 112.349 -179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.69 -174.48 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.9 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -100.85 166.88 10.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.84 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 97.0 m -52.6 -176.66 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 1.0 111.127 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -75.58 83.31 2.61 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.581 -0.736 . . . . 1.0 110.882 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 134.66 -25.47 3.41 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.729 -0.748 . . . . 1.0 112.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.2 m-30 -87.32 170.57 11.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.844 0.354 . . . . 1.0 110.918 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.7 m-85 -138.64 177.68 7.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.615 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 12.9 t -124.43 111.02 15.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.98 -0.555 . . . . 1.0 110.881 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.0 172.04 7.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.704 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.2 m -147.27 68.55 1.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.344 -0.389 . . . . 1.0 110.773 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -58.15 -171.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.075 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -64.85 78.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' TYR . 0.0 OUTLIER 175.31 128.52 0.13 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.687 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.39 73.65 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.492 2.128 . . . . 1.0 112.349 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.814 ' CG ' ' CD ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 175.88 92.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.795 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 88.8 m -60.53 132.11 52.88 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.551 -0.295 . . . . 1.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -101.53 153.24 19.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.76 0.314 . . . . 1.0 111.138 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -122.3 123.61 41.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.308 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.77 174.42 15.34 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.332 -0.395 . . . . 1.0 111.185 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.502 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 23.0 t30 -44.55 167.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.656 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.65 -77.34 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.015 -0.539 . . . . 1.0 111.11 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 t -130.65 136.26 48.65 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 118.18 -0.914 . . . . 1.0 110.94 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.777 0 O-C-N 123.573 0.546 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.825 0.345 . . . . 1.0 111.01 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.2 p -128.96 164.85 22.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.964 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.7 m -115.94 143.41 25.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.905 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.408 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 170.54 -158.79 30.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.441 -0.885 . . . . 1.0 112.895 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 55.26 58.84 4.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.914 0.387 . . . . 1.0 111.156 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.65 3.71 73.5 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.928 -0.654 . . . . 1.0 112.977 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.52 131.05 43.42 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.824 0.345 . . . . 1.0 111.213 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.39 124.28 23.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.689 179.509 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -60.19 137.95 58.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.563 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.716 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -47.46 146.71 1.96 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.31 -0.404 . . . . 1.0 111.302 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 t 34.78 -88.95 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.089 -0.505 . . . . 1.0 112.048 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.47 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.92 -36.08 1.82 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.745 0.307 . . . . 1.0 110.931 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 p -179.31 71.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 1.0 110.72 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -101.02 -85.69 1.88 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.858 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.716 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 31.6 Cg_exo -58.07 165.54 6.78 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.365 2.044 . . . . 1.0 112.392 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -100.12 146.85 26.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.651 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.8 158.95 30.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.893 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 76.9 m -54.14 -176.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.077 0.465 . . . . 1.0 110.961 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -85.45 107.21 17.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.027 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.51 -26.31 7.36 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.739 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.512 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.65 170.18 9.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 1.0 110.938 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.47 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.2 m-85 -136.76 178.79 6.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.684 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 36.6 t -123.31 118.69 28.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.825 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.06 129.32 46.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.846 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.9 m -106.34 47.48 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 1.0 110.821 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -57.91 -166.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.942 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -62.72 81.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 1.0 111.014 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.2 126.38 0.25 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 1.0 110.734 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -53.95 -27.31 44.2 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.416 2.077 . . . . 1.0 112.281 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.02 95.42 5.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.951 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 57.5 m -55.74 149.32 14.65 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 116.471 -0.331 . . . . 1.0 110.836 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 16.6 mtt85 -107.03 160.78 15.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.953 0.406 . . . . 1.0 111.136 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -131.6 127.78 37.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.196 179.646 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.29 174.47 14.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.741 0.305 . . . . 1.0 111.127 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.512 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 31.3 t-20 -43.07 165.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.718 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.47 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.57 -76.41 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.971 -0.559 . . . . 1.0 111.109 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 t -131.96 130.77 41.91 Favored 'General case' 0 C--O 1.249 1.057 0 CA-C-O 118.254 -0.879 . . . . 1.0 110.906 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.782 0 O-C-N 123.523 0.514 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.85 0.357 . . . . 1.0 111.058 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.18 164.71 12.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.885 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.8 m -84.11 148.63 4.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.296 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.73 -160.21 19.8 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.807 -0.711 . . . . 1.0 112.645 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -81.6 138.44 35.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.364 . . . . 1.0 111.031 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 68.42 9.93 59.09 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.956 -0.64 . . . . 1.0 112.814 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.47 127.64 33.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.682 0.277 . . . . 1.0 111.306 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.16 111.37 5.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.387 -0.37 . . . . 1.0 110.516 179.372 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 24.6 m -52.75 138.95 27.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.854 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.826 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.78 147.15 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.466 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 33.84 -89.2 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.121 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.46 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.83 -34.73 1.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.677 0.275 . . . . 1.0 110.96 179.829 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 p -177.7 70.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.404 . . . . 1.0 110.844 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.01 -81.3 1.58 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.751 -0.738 . . . . 1.0 112.749 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.826 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 51.5 Cg_endo -69.41 168.19 21.81 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.447 2.098 . . . . 1.0 112.46 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -97.4 -168.3 1.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.75 166.38 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.982 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 88.9 m -53.16 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.046 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -81.96 83.85 7.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.71 -0.677 . . . . 1.0 110.866 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.76 -26.61 2.75 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.731 -0.747 . . . . 1.0 112.613 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.511 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.05 170.16 10.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 1.0 110.923 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.473 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.5 m-85 -138.57 173.82 11.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.402 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.79 113.83 26.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.291 -0.413 . . . . 1.0 110.772 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.3 m -95.1 164.46 12.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.694 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.4 m -150.9 65.73 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.034 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -66.72 -163.95 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.66 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -63.44 80.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 1.0 110.911 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.37 155.04 5.98 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.824 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -73.55 -37.2 3.27 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.608 2.206 . . . . 1.0 112.415 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.17 122.82 40.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.047 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 36.7 m -72.01 162.65 29.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.391 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.77 172.47 11.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.087 0.47 . . . . 1.0 111.517 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.414 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -135.3 128.43 31.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.297 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 mtt180 -147.74 171.18 16.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.767 0.318 . . . . 1.0 111.065 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.511 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.6 t30 -50.5 170.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.339 -0.392 . . . . 1.0 111.257 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.473 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.65 -76.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.062 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.15 -35.09 10.89 Favored 'General case' 0 C--O 1.249 1.037 0 CA-C-O 118.2 -0.905 . . . . 1.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.801 0 O-C-N 123.554 0.533 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.796 0.331 . . . . 1.0 111.039 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.7 p -132.72 164.13 27.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.9 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.4 m -91.94 144.14 9.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.084 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.71 -160.32 13.45 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.766 -0.731 . . . . 1.0 112.663 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.93 138.8 33.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.79 0.328 . . . . 1.0 110.963 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 75.68 3.07 71.73 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.863 -0.684 . . . . 1.0 112.933 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.35 120.12 15.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.725 0.297 . . . . 1.0 111.112 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HG2' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.1 106.57 3.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.599 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 96.3 m -48.06 133.96 14.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.314 -0.403 . . . . 1.0 110.922 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.452 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -42.84 144.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.87 -90.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.931 -0.577 . . . . 1.0 112.117 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -124.58 -25.85 3.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.633 0.254 . . . . 1.0 111.238 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.2 p 178.92 71.68 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.856 0.36 . . . . 1.0 110.905 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.01 -95.72 1.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.736 -0.745 . . . . 1.0 112.631 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.452 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.9 Cg_exo -53.18 164.3 1.88 Allowed 'Trans proline' 0 N--CA 1.461 -0.396 0 C-N-CA 122.311 2.008 . . . . 1.0 112.444 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -107.08 149.41 27.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.439 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -71.54 160.27 33.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.86 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 82.9 m -58.74 -176.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.978 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -77.02 84.25 3.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.911 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 139.27 -27.07 2.66 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.754 -0.736 . . . . 1.0 112.607 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.476 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 5.2 m-30 -88.07 173.3 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.847 0.356 . . . . 1.0 110.943 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.48 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 24.5 m-85 -141.68 179.2 6.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.419 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.0 t -125.83 114.17 18.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.811 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.89 154.01 17.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 1.0 110.948 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.15 57.53 1.39 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.874 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.91 -175.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.9 82.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.958 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.78 145.15 0.46 Allowed Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.812 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -79.69 54.74 5.33 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.691 2.261 . . . . 1.0 112.46 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CD1' ' HG2' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.85 89.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.777 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.8 m -55.03 144.41 23.59 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.918 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -111.24 158.01 19.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.953 0.406 . . . . 1.0 111.031 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -117.93 127.64 54.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.604 179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -152.54 171.66 17.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.855 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.476 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 29.6 t30 -47.09 170.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 1.0 111.361 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.48 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.6 -76.71 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.088 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -129.89 121.76 27.28 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 118.249 -0.882 . . . . 1.0 110.885 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.787 0 O-C-N 123.576 0.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.779 0.323 . . . . 1.0 111.065 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.8 p -106.5 165.2 11.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.946 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -132.77 143.44 39.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.971 -0.558 . . . . 1.0 110.935 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 178.34 -158.06 22.46 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.438 -0.887 . . . . 1.0 113.001 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t70 56.55 66.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.909 0.385 . . . . 1.0 111.147 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.27 -2.73 80.63 Favored Glycine 0 CA--C 1.52 0.347 0 C-N-CA 120.948 -0.644 . . . . 1.0 112.912 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.57 119.09 14.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.724 0.262 . . . . 1.0 111.182 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 2.7 ptp180 -70.26 119.19 14.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.946 0.403 . . . . 1.0 110.623 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.69 140.41 23.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.035 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -46.59 147.89 1.12 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.254 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.939 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.457 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.32 -24.41 3.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.635 0.255 . . . . 1.0 111.1 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 p 175.02 73.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.824 0.345 . . . . 1.0 110.708 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.73 -94.12 2.02 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.753 -0.737 . . . . 1.0 112.902 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 44.0 Cg_exo -55.98 161.21 8.86 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.357 2.038 . . . . 1.0 112.466 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -96.19 152.58 18.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.678 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.14 156.85 28.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 1.0 110.959 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 74.4 m -53.76 -176.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.105 0.479 . . . . 1.0 110.959 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -83.16 93.96 7.75 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.782 -0.645 . . . . 1.0 111.036 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.45 3.52 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.656 -0.783 . . . . 1.0 112.778 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.511 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.15 170.1 9.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 1.0 111.05 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.474 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 20.3 m-85 -137.3 179.12 6.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.372 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 19.0 t -126.24 113.76 17.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.455 . . . . 1.0 111.004 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.45 139.43 32.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.529 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.5 m -116.19 52.38 0.92 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.962 0.411 . . . . 1.0 111.006 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.8 ttm180 -58.46 -163.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.769 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.57 81.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.487 -0.324 . . . . 1.0 110.978 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 178.96 147.8 0.4 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.726 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.79 -34.67 6.56 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.548 2.165 . . . . 1.0 112.252 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.449 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -97.01 96.45 8.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.835 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.4 m -55.45 151.55 10.06 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.492 -0.322 . . . . 1.0 110.731 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -108.58 142.39 39.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.884 0.373 . . . . 1.0 111.115 -179.546 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.461 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -114.22 124.02 51.01 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.122 179.453 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.31 174.05 15.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.157 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.511 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 26.8 t30 -43.2 165.87 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.462 . . . . 1.0 111.675 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.8 p30 -69.56 -77.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.091 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.71 126.31 44.29 Favored 'General case' 0 C--O 1.249 1.06 0 CA-C-O 118.231 -0.89 . . . . 1.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.779 0 CA-C-N 118.295 0.498 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.866 0.365 . . . . 1.0 110.992 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.6 p -147.46 165.6 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 1.0 110.946 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -122.88 149.16 26.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.894 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 167.59 -158.4 31.24 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.37 -0.919 . . . . 1.0 112.905 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.1 t70 56.13 58.74 4.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.385 . . . . 1.0 111.216 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.23 -0.52 83.85 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.824 -0.703 . . . . 1.0 113.011 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.26 129.32 39.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.778 0.323 . . . . 1.0 111.264 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.49 122.9 20.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 1.0 110.585 179.541 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 7.5 m -55.54 141.22 37.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.496 -0.32 . . . . 1.0 110.614 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.658 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -49.24 145.16 4.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.363 -0.38 . . . . 1.0 111.216 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.85 -89.0 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.042 -0.526 . . . . 1.0 112.053 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.471 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.04 -35.83 2.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.731 0.301 . . . . 1.0 111.01 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.7 p -179.57 71.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.889 0.376 . . . . 1.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.29 -87.48 1.93 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.739 -0.744 . . . . 1.0 112.735 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.658 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 38.6 Cg_exo -59.77 168.26 5.82 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.401 2.068 . . . . 1.0 112.36 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -105.12 147.11 28.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.634 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.64 158.06 36.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.863 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 69.7 m -53.84 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.107 0.48 . . . . 1.0 111.079 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -82.6 105.06 13.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.974 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 121.08 -25.94 6.91 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.652 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.508 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.02 170.53 9.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.788 0.328 . . . . 1.0 110.959 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -136.48 179.85 6.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.696 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.5 t -126.31 114.83 18.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.937 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -99.02 168.84 9.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.428 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.3 m -148.71 66.43 1.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.912 0.387 . . . . 1.0 111.189 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -162.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.55 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 75.8 m -67.21 66.95 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.32 -0.4 . . . . 1.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 5.2 mmt -159.98 135.46 5.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.729 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.17 -29.52 75.66 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.398 2.065 . . . . 1.0 112.432 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.21 119.72 36.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 1.0 111.126 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.3 m -71.84 151.01 43.77 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.291 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -110.44 154.91 22.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.858 0.361 . . . . 1.0 111.267 -179.282 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.441 ' HB3' ' HA2' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -131.1 127.54 38.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.068 -0.514 . . . . 1.0 110.1 179.406 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -162.29 173.78 13.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.747 0.308 . . . . 1.0 111.154 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.508 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 40.8 t30 -43.16 165.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.161 -0.472 . . . . 1.0 111.709 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.468 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.58 -76.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.096 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.59 125.71 53.68 Favored 'General case' 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 1.0 110.926 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.797 0 O-C-N 123.533 0.52 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.835 0.35 . . . . 1.0 111.031 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p -109.92 164.32 12.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.943 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.464 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -81.98 147.29 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.267 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.15 -160.11 7.98 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.85 -0.69 . . . . 1.0 112.623 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.98 138.76 33.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.863 0.363 . . . . 1.0 110.995 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.92 12.75 58.07 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.87 -0.681 . . . . 1.0 112.864 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.4 127.77 33.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 1.0 111.09 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.2 111.22 5.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.623 179.554 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' CE1' ' A' ' 30' ' ' TYR . 70.5 m -52.87 134.44 37.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.744 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.749 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -43.68 143.88 0.92 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.298 -0.41 . . . . 1.0 111.575 -179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.17 -90.13 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.945 -0.57 . . . . 1.0 112.151 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.445 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -130.39 -30.46 1.91 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.663 0.268 . . . . 1.0 111.262 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -178.71 70.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.819 0.342 . . . . 1.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.65 -84.0 1.75 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.755 -0.736 . . . . 1.0 112.743 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.749 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.6 Cg_endo -71.61 168.56 23.3 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.472 2.115 . . . . 1.0 112.443 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -97.51 -170.8 2.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.964 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.464 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.1 OUTLIER -115.55 165.75 12.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.883 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 83.6 m -53.51 -176.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 1.0 111.059 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.84 84.22 7.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.877 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 140.01 -26.6 2.6 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.703 -0.761 . . . . 1.0 112.594 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.7 m-30 -90.38 169.82 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.813 0.34 . . . . 1.0 110.939 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 11.2 m-85 -137.2 174.17 10.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.432 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 51.8 t -113.29 113.21 24.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.312 -0.403 . . . . 1.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 t -94.16 167.47 11.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 1.0 110.665 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 62.8 m -150.62 63.86 0.94 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.956 0.408 . . . . 1.0 111.085 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -63.31 -163.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.604 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.17 81.9 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.829 0.347 . . . . 1.0 110.871 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.28 149.69 0.68 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.848 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.95 -36.68 7.29 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 1.0 112.371 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.451 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER -90.19 112.21 23.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.932 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.7 m -67.01 162.16 22.7 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.555 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER -126.29 170.22 12.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.009 0.433 . . . . 1.0 111.387 -179.634 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.06 129.53 34.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.796 -0.638 . . . . 1.0 110.409 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -151.13 169.97 20.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.782 0.325 . . . . 1.0 110.976 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.507 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 38.9 t30 -49.09 170.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 1.0 111.276 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.477 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.5 p30 -69.67 -76.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.999 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 63.4 p -150.49 136.14 18.18 Favored 'General case' 0 C--O 1.249 1.034 0 CA-C-O 118.174 -0.917 . . . . 1.0 110.877 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.248 -3.809 0 O-C-N 123.603 0.565 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.854 0.359 . . . . 1.0 111.04 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HB2' ' N ' ' A' ' 18' ' ' CYS . 27.9 p -125.91 166.55 16.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.983 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.51 HG12 ' CG ' ' A' ' 7' ' ' GLN . 0.1 OUTLIER -93.25 164.76 2.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.096 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.71 -160.71 32.45 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.859 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -88.19 132.48 34.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.891 0.377 . . . . 1.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 70.39 6.96 59.59 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.961 -0.637 . . . . 1.0 112.826 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.51 ' CG ' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.97 129.48 39.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.584 0.231 . . . . 1.0 111.23 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.37 112.22 6.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.969 0.414 . . . . 1.0 110.562 179.507 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 19.2 m -50.51 139.84 15.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.312 -0.404 . . . . 1.0 110.856 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 12' ' ' TRP . . . -44.31 145.84 0.76 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.404 -0.362 . . . . 1.0 111.314 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 35.49 -90.46 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.729 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.462 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -142.48 5.03 1.6 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 111.473 0.175 . . . . 1.0 111.473 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 12' ' ' TRP . 1.7 p 163.31 77.42 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.717 0.294 . . . . 1.0 110.558 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.66 -100.06 2.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.602 -0.809 . . . . 1.0 113.063 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.455 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 50.5 Cg_exo -53.15 165.95 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.426 2.084 . . . . 1.0 112.705 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -108.94 149.39 29.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 1.0 110.618 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.09 157.35 38.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 1.0 111.026 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 21' ' ' TYR . 76.1 m -62.45 -176.62 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.914 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.43 94.04 2.03 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.98 -9.24 7.12 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 1.0 112.739 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 21' ' ' TYR . 2.0 m-85 -110.62 170.75 7.89 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.749 0.309 . . . . 1.0 110.775 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 36' ' ' ASN . 18.5 m-85 -142.44 173.64 11.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.266 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.4 t -117.35 114.43 23.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.25 -0.432 . . . . 1.0 111.188 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -95.77 169.47 9.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.37 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 85.3 m -151.32 70.29 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.954 0.407 . . . . 1.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -62.12 -164.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.635 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -69.5 65.06 0.18 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.903 0.382 . . . . 1.0 111.159 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 9.1 mmt -155.83 157.12 31.3 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.788 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.48 -45.52 0.57 Allowed 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.514 2.142 . . . . 1.0 112.378 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.54 107.57 16.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 1.0 110.857 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 9' ' ' CYS . 35.6 m -61.21 167.6 3.03 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.253 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.512 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -128.21 164.25 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.085 0.469 . . . . 1.0 111.795 -179.413 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.443 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.21 124.96 23.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.189 179.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -145.21 172.68 12.78 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.831 0.348 . . . . 1.0 111.096 -179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.451 ' HA ' ' CD2' ' A' ' 21' ' ' TYR . 19.3 t30 -50.97 171.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.923 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HA ' ' CD2' ' A' ' 22' ' ' TYR . 1.4 p30 -69.9 -77.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.985 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.6 m -133.68 124.16 26.25 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-O 118.194 -0.908 . . . . 1.0 110.887 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.782 0 O-C-N 123.545 0.528 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.794 0.331 . . . . 1.0 111.071 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 29.9 p -164.49 163.91 21.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.93 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.3 m -92.63 145.27 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 1.0 111.129 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.05 -160.95 8.44 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.811 -0.709 . . . . 1.0 112.715 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.71 135.0 33.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.847 0.356 . . . . 1.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.01 0.87 77.6 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.865 -0.683 . . . . 1.0 112.772 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -70.45 128.39 36.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.726 0.298 . . . . 1.0 111.229 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.32 115.5 9.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 1.0 110.556 179.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 64.1 m -55.77 135.65 51.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.436 -0.347 . . . . 1.0 110.561 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB3' ' CD ' ' A' ' 15' ' ' PRO . . . -44.55 146.44 0.72 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.543 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.38 -90.03 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.042 -0.527 . . . . 1.0 111.986 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -128.65 -23.75 3.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.599 0.238 . . . . 1.0 111.305 179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p 177.36 72.54 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.885 0.374 . . . . 1.0 110.764 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.19 -94.24 2.06 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.822 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.534 ' CD ' ' HB3' ' A' ' 10' ' ' ALA . 51.3 Cg_exo -53.48 165.1 1.73 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.353 2.035 . . . . 1.0 112.574 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -108.49 149.44 28.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.653 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.83 157.22 38.48 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.893 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 61.3 m -57.28 -176.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.088 0.47 . . . . 1.0 110.957 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -75.68 87.47 2.74 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.942 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 135.75 -27.31 3.08 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.598 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.522 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.0 m-30 -91.33 170.45 9.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.723 0.297 . . . . 1.0 110.783 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.491 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.1 m-85 -139.71 173.59 11.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.572 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 52.2 t -111.43 112.99 25.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.687 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -91.94 166.03 12.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.695 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 79.5 m -151.22 66.42 0.9 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.985 0.422 . . . . 1.0 110.993 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 -68.17 -163.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.663 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -63.83 79.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.984 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.1 141.07 0.42 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.212 -0.449 . . . . 1.0 110.778 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -56.02 -62.68 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.469 2.112 . . . . 1.0 112.294 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.88 115.02 6.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.999 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.1 m -69.6 169.32 12.93 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 116.326 -0.397 . . . . 1.0 110.329 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.8 OUTLIER -129.1 170.02 14.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.07 0.462 . . . . 1.0 111.467 -179.653 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.419 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -139.43 126.89 21.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.394 179.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.27 173.34 15.14 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.863 0.363 . . . . 1.0 111.054 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 33.3 t30 -47.51 170.64 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.406 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.491 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.2 p30 -69.54 -76.43 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 1.0 111.042 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.4 136.2 53.88 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 118.203 -0.903 . . . . 1.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.788 0 O-C-N 123.547 0.529 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.823 0.344 . . . . 1.0 111.041 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p -137.21 163.52 30.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 1.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.6 m -111.83 162.96 9.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.058 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.16 -160.32 31.55 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.645 -0.788 . . . . 1.0 112.595 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 t0 53.13 63.75 2.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.883 0.373 . . . . 1.0 111.074 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 78.39 2.02 83.08 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.901 -0.666 . . . . 1.0 112.871 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -70.34 123.2 21.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.736 0.303 . . . . 1.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -70.18 122.78 20.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.814 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 79.8 m -59.62 142.11 53.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.521 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.71 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.18 140.6 3.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.371 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 t 35.21 -90.74 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.005 -0.543 . . . . 1.0 112.098 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -126.81 -29.74 2.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.697 0.284 . . . . 1.0 111.129 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p 178.23 72.14 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 1.0 110.771 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.45 -91.58 1.57 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.701 -0.762 . . . . 1.0 112.74 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.71 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 71.9 Cg_endo -75.19 168.53 24.5 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.471 2.114 . . . . 1.0 112.466 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -81.62 -170.49 2.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -129.38 165.79 20.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.505 . . . . 1.0 110.796 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 80.8 m -53.68 -176.42 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.99 -0.55 . . . . 1.0 111.045 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -93.59 124.75 37.79 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.749 -0.659 . . . . 1.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.85 -27.69 14.11 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.709 -0.757 . . . . 1.0 112.623 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.504 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.1 m-30 -95.67 170.32 9.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.838 0.351 . . . . 1.0 110.933 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 16.3 m-85 -135.82 177.19 8.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.053 -0.522 . . . . 1.0 110.411 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.7 t -127.67 110.69 12.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.973 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -99.2 170.99 8.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.68 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.6 m -142.17 65.75 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.931 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.6 ttm-85 -60.08 -168.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.91 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 m -64.99 78.13 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.034 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.432 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER 179.71 129.74 0.24 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 1.0 110.725 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 18.9 Cg_exo -66.26 63.76 0.49 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.527 2.152 . . . . 1.0 112.307 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 177.13 94.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.861 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 85.6 m -56.97 136.36 56.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.395 -0.366 . . . . 1.0 110.782 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.97 142.64 34.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.94 0.4 . . . . 1.0 111.095 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -109.11 124.97 51.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.422 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -153.04 170.83 19.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.446 -0.343 . . . . 1.0 111.014 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.504 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.3 t30 -46.39 168.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.332 -0.394 . . . . 1.0 111.454 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.46 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.72 -76.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.096 -0.502 . . . . 1.0 111.077 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 43.5 t -104.97 139.42 39.69 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-O 118.272 -0.87 . . . . 1.0 110.896 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.763 0 O-C-N 123.479 0.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.858 0.361 . . . . 1.0 111.009 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.5 p -133.81 164.13 27.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.969 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.469 HG12 ' OE1' ' A' ' 7' ' ' GLN . 6.1 m -116.62 163.87 13.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 1.0 111.037 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.17 -160.25 31.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.676 -0.773 . . . . 1.0 112.67 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 t70 53.59 66.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 1.0 111.102 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 81.05 -2.09 82.31 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.963 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.469 ' OE1' HG12 ' A' ' 3' ' ' VAL . 0.4 OUTLIER -70.59 116.62 11.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.652 0.263 . . . . 1.0 111.117 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 0.2 OUTLIER -70.3 118.51 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.888 0.375 . . . . 1.0 110.879 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 88.0 m -51.23 138.92 19.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.93 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.729 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -44.46 146.04 0.76 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.318 -0.401 . . . . 1.0 111.482 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.4 t 34.8 -90.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.963 -0.562 . . . . 1.0 112.032 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.456 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.88 -30.58 2.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 1.0 111.034 179.764 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 49.1 p -179.44 71.28 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.858 0.361 . . . . 1.0 110.641 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.52 -91.01 1.75 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 1.0 112.757 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.729 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 58.9 Cg_endo -72.17 168.25 24.6 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 122.442 2.094 . . . . 1.0 112.478 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -87.26 -175.06 5.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.84 164.92 18.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.868 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.8 m -54.1 -176.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.01 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -93.5 118.46 31.37 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.668 -0.697 . . . . 1.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 115.16 -27.43 8.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.708 -0.758 . . . . 1.0 112.636 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.506 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.9 m-30 -95.51 170.2 9.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.897 0.379 . . . . 1.0 110.892 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.463 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 15.0 m-85 -135.77 176.24 8.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.239 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 33.8 t -127.65 109.19 11.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.34 151.07 21.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 1.0 110.448 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.2 m -124.51 56.56 1.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 1.0 111.088 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -59.48 -175.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.839 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -61.28 85.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 1.0 111.006 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.35 145.12 0.43 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.862 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.02 54.34 5.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.67 2.247 . . . . 1.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.436 ' CD1' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER 174.41 92.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.64 179.993 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 58.4 m -52.75 144.46 14.19 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.454 -0.339 . . . . 1.0 110.764 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -104.58 141.97 35.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.834 0.35 . . . . 1.0 111.023 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -114.09 122.22 46.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.219 179.431 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.66 172.02 16.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.291 -0.413 . . . . 1.0 111.125 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.506 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 43.8 t30 -46.0 168.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.455 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.1 p30 -69.59 -76.92 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 1.0 111.085 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.36 132.16 55.7 Favored 'General case' 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 1.0 110.887 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.248 -3.808 0 O-C-N 123.519 0.512 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.851 0.358 . . . . 1.0 111.029 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 31.1 p -129.72 164.17 24.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.964 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.9 m -112.97 163.04 10.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.947 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.97 -160.02 30.06 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.573 -0.822 . . . . 1.0 112.738 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.58 52.5 12.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.872 0.368 . . . . 1.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.11 -0.16 83.62 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 120.858 -0.686 . . . . 1.0 112.949 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.29 126.46 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.74 0.305 . . . . 1.0 111.02 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 32' ' ' ARG . 1.5 mpp_? -70.15 124.85 25.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.37 . . . . 1.0 110.835 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.9 m -57.97 138.97 55.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.268 -0.423 . . . . 1.0 110.605 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.875 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.38 143.62 1.73 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.393 . . . . 1.0 111.449 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.3 t 35.43 -89.31 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.985 -0.552 . . . . 1.0 112.128 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.461 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.15 -38.76 1.59 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.718 0.294 . . . . 1.0 110.802 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.3 p -177.12 69.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 1.0 110.787 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.06 -81.26 1.59 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.734 -0.746 . . . . 1.0 112.728 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.875 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 61.4 Cg_endo -73.39 167.76 26.47 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.451 2.1 . . . . 1.0 112.44 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -89.05 -171.64 3.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 1.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.03 164.39 20.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.815 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 65.8 m -54.16 -176.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.157 0.503 . . . . 1.0 110.932 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -90.88 122.54 33.67 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 1.0 111.083 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 107.98 -26.3 17.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 1.0 112.661 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.4 m-30 -95.66 170.72 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.825 0.345 . . . . 1.0 111.059 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.465 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 19.5 m-85 -135.85 178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.595 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 44.4 t -127.53 105.94 8.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.974 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.48 170.27 10.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.704 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 m -147.18 68.27 1.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.318 -0.401 . . . . 1.0 110.881 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm-85 -62.04 -171.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.95 80.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.991 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.09 144.04 0.49 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.859 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.16 58.21 6.12 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.619 2.212 . . . . 1.0 112.449 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.78 97.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.844 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 91.9 m -58.98 147.17 35.43 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.706 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -112.86 142.9 44.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 1.0 111.087 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.02 125.55 54.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.327 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 173.23 16.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.134 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.5 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 39.5 t30 -45.0 167.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.501 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.465 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.72 -76.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.045 -179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 p -131.88 134.12 45.37 Favored 'General case' 0 C--O 1.249 1.042 0 CA-C-O 118.22 -0.895 . . . . 1.0 110.928 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.766 0 O-C-N 123.53 0.519 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.802 0.334 . . . . 1.0 111.086 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p -145.08 163.69 33.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.941 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.417 HG12 ' NE2' ' A' ' 7' ' ' GLN . 6.0 m -99.46 143.39 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.168 -0.469 . . . . 1.0 110.854 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.29 174.05 44.22 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.45 -0.881 . . . . 1.0 113.032 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.27 75.21 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.874 0.369 . . . . 1.0 111.349 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 72.07 6.4 64.3 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 121.006 -0.616 . . . . 1.0 113.211 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' NE2' HG12 ' A' ' 3' ' ' VAL . 0.2 OUTLIER -70.54 118.95 13.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.934 0.367 . . . . 1.0 111.215 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.18 109.52 4.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.661 179.581 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.0 m -49.73 139.72 12.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.383 -0.371 . . . . 1.0 110.902 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.774 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -45.51 141.29 2.78 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.482 -179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 34.59 -89.62 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.973 -0.558 . . . . 1.0 112.201 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.454 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -127.23 -36.42 2.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.722 0.296 . . . . 1.0 110.983 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -178.67 70.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.862 0.363 . . . . 1.0 110.828 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.11 -91.05 1.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.72 -0.752 . . . . 1.0 112.647 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.774 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 57.9 Cg_endo -71.58 168.33 23.93 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.467 2.111 . . . . 1.0 112.397 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -78.12 -175.32 4.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.91 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.0 t -117.67 165.25 13.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 66.1 m -53.62 -176.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.042 -0.526 . . . . 1.0 111.056 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -94.44 118.03 31.03 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.057 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.16 -29.47 9.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.583 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.52 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 2.3 m-30 -97.33 169.81 9.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.777 0.322 . . . . 1.0 110.831 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.469 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 12.2 m-85 -133.39 175.31 9.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.209 -0.45 . . . . 1.0 110.396 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.3 t -119.12 112.68 19.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.001 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -95.93 151.19 19.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.811 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 71.0 m -127.08 57.73 1.46 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.443 . . . . 1.0 110.962 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -61.63 -171.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.834 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 m -62.81 83.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.056 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.93 143.53 0.49 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.806 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.77 53.42 4.77 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.709 2.273 . . . . 1.0 112.576 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.446 ' CE1' ' HB3' ' A' ' 8' ' ' ARG . 0.2 OUTLIER 177.33 90.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.329 -0.396 . . . . 1.0 110.82 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 56.2 m -55.26 142.76 30.43 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.889 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.1 OUTLIER -112.77 153.79 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.947 0.403 . . . . 1.0 111.134 -179.686 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' TYR . 0.1 OUTLIER -112.31 125.22 53.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.556 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 ttt180 -146.37 166.46 26.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.52 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 41.2 t30 -45.69 168.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 1.0 111.486 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.469 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 2.0 p30 -69.71 -77.02 0.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 1.0 111.073 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.4 130.25 45.66 Favored 'General case' 0 C--O 1.248 1.022 0 CA-C-O 118.29 -0.862 . . . . 1.0 110.921 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.748 0 O-C-N 123.503 0.502 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.815 0.34 . . . . 1.0 111.024 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -140.82 164.5 30.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.917 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.1 m -121.92 162.51 21.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.071 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 33' ' ' CYS . . . 161.52 -159.12 30.98 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.598 -0.811 . . . . 1.0 112.851 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.5 t70 55.23 60.43 3.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.933 0.397 . . . . 1.0 111.241 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' CYS . . . 80.1 -0.58 83.13 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.826 -0.702 . . . . 1.0 112.955 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -70.25 133.61 47.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.786 0.327 . . . . 1.0 111.25 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.43 124.7 24.84 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.201 -0.454 . . . . 1.0 110.687 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.6 m -58.19 144.56 40.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.542 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.863 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -51.81 141.23 17.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.49 -0.323 . . . . 1.0 111.048 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.406 ' OG ' ' N ' ' A' ' 12' ' ' TRP . 1.2 t 35.42 -88.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.073 -0.512 . . . . 1.0 112.101 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.474 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -129.45 -39.59 1.48 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.75 0.31 . . . . 1.0 110.883 179.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 p -178.22 70.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.721 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -99.92 -81.81 1.62 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.746 -0.74 . . . . 1.0 112.702 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.863 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 60.6 Cg_endo -73.21 168.25 25.22 Favored 'Trans proline' 0 N--CA 1.463 -0.273 0 C-N-CA 122.347 2.032 . . . . 1.0 112.379 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -96.78 159.83 14.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.91 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.58 164.65 15.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.87 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.5 m -53.79 -176.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.021 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.96 113.93 22.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.976 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 113.31 -26.51 10.27 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.743 -0.741 . . . . 1.0 112.629 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 3.5 m-30 -95.48 170.89 9.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 1.0 111.023 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.458 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 22.0 m-85 -136.49 -179.3 5.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.683 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.9 t -126.02 119.05 26.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.948 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 32' ' ' ARG . 1.2 m -101.48 166.91 10.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.492 . . . . 1.0 110.42 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.1 m -149.08 53.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.895 0.379 . . . . 1.0 111.065 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.55 -163.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 1.0 110.568 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -60.19 83.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.839 0.352 . . . . 1.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.417 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.1 OUTLIER -177.85 131.21 0.32 Allowed Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.71 -179.987 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 48.7 Cg_exo -55.96 -26.53 59.12 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.485 2.123 . . . . 1.0 112.518 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.67 125.44 48.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.417 -0.356 . . . . 1.0 111.211 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 34.1 m -74.44 146.02 43.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.203 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 24' ' ' SER . 0.1 OUTLIER -108.12 160.85 15.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 1.0 111.436 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.408 ' O ' ' N ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -136.36 130.43 32.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.189 179.489 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -164.13 173.71 12.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.771 0.319 . . . . 1.0 111.013 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.494 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 21.6 t30 -43.07 164.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.582 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.458 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.9 p30 -69.69 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.043 -179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.8 t -111.1 111.66 22.92 Favored 'General case' 0 C--O 1.249 1.055 0 CA-C-O 118.259 -0.876 . . . . 1.0 110.895 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.25 -3.76 0 O-C-N 123.479 0.487 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.786 0.327 . . . . 1.0 111.046 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.5 p -123.02 164.21 19.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.904 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 17' ' ' CYS . 16.8 m -85.45 149.5 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.231 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.16 -160.22 17.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 1.0 112.568 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.41 133.07 33.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.356 . . . . 1.0 110.959 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 81.06 -1.79 83.46 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.794 -0.717 . . . . 1.0 112.928 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -70.36 126.26 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.732 0.301 . . . . 1.0 111.144 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' CD1' ' A' ' 30' ' ' TYR . 0.0 OUTLIER -70.11 121.49 17.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.792 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -59.02 142.37 51.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.762 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.645 ' HB3' ' HD2' ' A' ' 15' ' ' PRO . . . -46.85 142.38 3.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.422 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.5 t 34.49 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.013 -0.539 . . . . 1.0 112.19 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.44 ' N ' ' O ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -125.29 -31.36 3.06 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.666 0.269 . . . . 1.0 111.089 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -179.03 70.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.833 0.349 . . . . 1.0 110.851 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -92.95 -86.46 1.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.694 -0.765 . . . . 1.0 112.629 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.645 ' HD2' ' HB3' ' A' ' 10' ' ' ALA . 63.4 Cg_endo -74.09 168.21 25.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.415 2.077 . . . . 1.0 112.378 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -99.28 173.1 6.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' HG22 ' A' ' 3' ' ' VAL . 0.0 OUTLIER -94.81 165.3 12.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.911 179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 84.4 m -53.95 -176.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.988 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.12 84.23 5.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.691 -0.686 . . . . 1.0 110.927 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 138.77 -25.8 2.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.672 -0.775 . . . . 1.0 112.674 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' A' ' 35' ' ' ASN . 4.1 m-30 -87.51 171.68 10.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.853 0.359 . . . . 1.0 110.98 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.456 ' CE2' ' HB3' ' A' ' 36' ' ' ASN . 21.5 m-85 -138.54 178.97 6.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.002 -0.545 . . . . 1.0 110.589 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 48.6 t -129.76 114.83 16.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 1.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -102.7 173.92 6.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 1.0 110.959 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.5 m -145.13 66.0 1.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.868 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.46 -167.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.833 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 m -65.11 78.02 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.966 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.47 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 0.0 OUTLIER -179.83 128.49 0.24 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.732 -179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 28' ' ' MET . 20.2 Cg_exo -65.72 64.09 0.41 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.54 2.16 . . . . 1.0 112.334 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.441 ' CD1' ' HB3' ' A' ' 8' ' ' ARG . 0.3 OUTLIER 177.79 94.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.796 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.6 m -57.21 134.68 56.13 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.946 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -103.31 153.65 20.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 1.0 111.005 -179.621 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.3 128.42 54.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.448 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.48 172.23 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.032 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.475 ' HA ' ' CD1' ' A' ' 21' ' ' TYR . 35.0 t30 -46.74 169.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.396 -0.366 . . . . 1.0 111.447 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.456 ' HB3' ' CE2' ' A' ' 22' ' ' TYR . 1.6 p30 -69.72 -77.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.077 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -107.64 -166.0 1.11 Allowed 'General case' 0 C--O 1.249 1.044 0 CA-C-O 118.209 -0.9 . . . . 1.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.249 -3.785 0 O-C-N 123.578 0.549 . . . . 1.0 . . . . . . . . . . 0 0 . 1 stop_ save_