data_2fgx_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 2fgx _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 N--CA 1.449 -0.511 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -81.39 173.95 11.09 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.786 2.324 . . . . 0.0 113.044 -171.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -103.75 140.47 37.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.415 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 0.5 OUTLIER -86.66 146.96 26.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 -176.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 61' ' ' LEU . 96.3 mt -122.16 137.65 54.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.355 0.598 . . . . 0.0 111.216 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.501 HG21 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -119.35 139.62 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.144 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 53.0 t -110.89 114.01 45.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 120.923 0.392 . . . . 0.0 110.133 175.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -82.31 132.57 35.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.165 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.61 -163.58 13.56 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -157.47 121.37 4.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.93 -171.39 0.16 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.475 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.16 98.14 2.21 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.23 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.44 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 38.8 t -108.1 142.36 38.41 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -60.28 -44.44 95.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.43 -35.18 71.7 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.184 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.503 ' O ' HG13 ' A' ' 25' ' ' ILE . 77.9 m -62.51 -49.99 73.17 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 175.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.65 -44.11 93.67 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.326 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.684 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 81.1 mtp -69.09 -37.95 78.7 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.918 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 21' ' ' CYS . 71.5 mt -56.91 -48.92 80.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 175.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.409 ' O ' HG21 ' A' ' 30' ' ' VAL . . . -59.53 -41.17 89.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.651 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.7 m -61.42 -46.7 89.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.899 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.477 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 93.2 mt -72.61 -31.31 65.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.381 -177.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -63.61 -39.02 93.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.921 0.391 . . . . 0.0 110.393 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 26' ' ' ALA . 91.7 t -65.95 -44.9 92.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.31 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.45 HD21 ' HA ' ' A' ' 31' ' ' LEU . 11.9 mt -62.73 -35.6 80.27 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.527 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.425 ' HA ' ' O ' ' A' ' 35' ' ' SER . 40.0 mt-30 -58.68 -21.38 54.27 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -74.69 -30.91 61.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.026 0.441 . . . . 0.0 110.738 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -91.17 -46.52 8.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.095 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.564 ' HB3' HD12 ' A' ' 84' ' ' LEU . 23.2 m -138.5 115.86 11.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.66 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -78.59 131.9 36.92 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.538 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.477 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 3.6 p90 -145.46 13.8 1.39 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 57.64 179.86 0.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.516 -175.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 tp -152.02 114.74 4.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.501 ' HB3' HG21 ' A' ' 11' ' ' VAL . 13.2 tt0 -129.64 120.34 25.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.309 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.3 116.86 45.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.954 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.5 mt -114.22 130.15 68.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -175.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -74.98 119.53 19.28 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.623 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.522 HD11 ' HA ' ' A' ' 51' ' ' THR . 20.6 pt -88.12 -15.52 9.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.118 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -54.81 -37.26 65.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.372 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.94 -51.12 15.72 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.978 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -82.01 93.81 7.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.018 0.437 . . . . 0.0 110.739 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.91 -18.94 65.67 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.257 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.56 -43.42 98.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 171.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.71 -36.93 73.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.296 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.522 ' HA ' HD11 ' A' ' 44' ' ' ILE . 92.0 m -64.35 -34.85 79.1 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.582 176.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.3 -35.71 81.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.157 0.503 . . . . 0.0 109.866 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.61 -51.02 21.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.399 178.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -108.65 -64.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.888 -170.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.2 t30 55.37 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.349 0.66 . . . . 0.0 112.152 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -84.07 -29.27 26.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 -174.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HA ' ' CE1' ' A' ' 73' ' ' TYR . 1.1 mpt_? -95.26 66.87 2.94 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.667 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -85.73 -122.71 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.632 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.751 179.059 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.667 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 88.3 Cg_exo -10.33 66.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.449 2.1 . . . . 0.0 113.409 -142.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.576 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -91.71 127.0 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.971 -167.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 10' ' ' LEU . 2.4 tm? -91.17 103.7 16.35 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.385 -177.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.48 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 79.2 t80 -95.57 136.89 35.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.754 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.54 109.3 20.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 21.4 t -85.72 153.69 3.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 71.71 22.09 4.1 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -173.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -157.44 -39.38 0.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.072 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.48 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 69.96 60.15 0.26 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.245 172.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.408 ' HZ3' ' HB3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -156.58 158.67 37.52 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.022 176.391 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -82.93 139.09 33.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.0 mt -105.23 -64.52 1.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.444 0.64 . . . . 0.0 110.09 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 71.0 m -132.14 -177.11 4.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.333 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 10.9 p80 -144.41 -170.32 3.34 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.413 ' CE1' ' HA ' ' A' ' 57' ' ' ARG . 15.3 p90 -39.67 134.05 1.4 Allowed 'General case' 0 C--O 1.238 0.492 0 O-C-N 124.081 0.863 . . . . 0.0 111.073 175.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 73.31 95.76 0.07 Allowed 'General case' 0 N--CA 1.464 0.229 0 O-C-N 124.474 1.109 . . . . 0.0 109.426 -171.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.5 tp -60.31 128.6 37.51 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.443 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -78.84 -32.71 46.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.1 m 69.98 -51.25 0.64 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.281 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -56.38 -48.04 77.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.986 0.422 . . . . 0.0 111.574 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 33.8 t -64.25 -51.67 65.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.369 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.768 HD12 HD21 ' A' ' 84' ' ' LEU . 7.9 tp -68.97 -25.87 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.513 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.647 ' O ' ' O ' ' A' ' 85' ' ' SER . . . -64.35 -44.69 95.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.417 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.94 -24.49 65.19 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.241 0.544 . . . . 0.0 110.818 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -87.9 -57.05 3.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.163 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.768 HD21 HD12 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -71.94 -39.79 69.18 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.7 -170.506 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.647 ' O ' ' O ' ' A' ' 81' ' ' GLY . 32.6 t . . . . . 0 C--N 1.324 -0.524 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -174.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 110.141 -0.318 . . . . 72.51 110.141 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.07 143.42 36.05 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.107 1.871 . . . . 72.33 111.839 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 1.001 ' NH1' ' O ' ' A' ' 85' ' ' SER . 10.8 ptp180 -97.73 171.39 8.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.761 -0.654 . . . . 73.42 109.751 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 84.4 tttt -135.79 152.78 51.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.048 0.452 . . . . 75.31 111.748 -174.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.645 HD13 ' CD1' ' A' ' 37' ' ' PHE . 95.4 mt -122.58 147.52 46.3 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.38 -0.827 . . . . 72.5 110.838 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.569 HG23 ' CG2' ' A' ' 64' ' ' VAL . 78.0 t -122.91 133.56 68.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.864 -0.607 . . . . 73.14 110.17 175.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.565 HG23 HD22 ' A' ' 61' ' ' LEU . 72.6 t -105.37 114.32 44.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 120.941 0.4 . . . . 71.43 110.304 175.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.11 117.88 29.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.937 -0.574 . . . . 75.32 110.074 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.446 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.28 163.91 26.66 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.271 -0.966 . . . . 74.15 112.56 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.454 ' CG ' HG13 ' A' ' 58' ' ' VAL . 3.3 ptm180 -150.29 114.31 5.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.252 -0.277 . . . . 71.4 110.252 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.68 17.93 4.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.715 -0.675 . . . . 71.04 112.549 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.58 64.92 0.36 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.071 -0.585 . . . . 74.21 111.76 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.16 -47.68 84.91 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.437 0.295 . . . . 63.41 111.478 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.9 t-160 -68.54 -47.25 67.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.519 -0.31 . . . . 72.21 110.546 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -36.08 82.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.323 -0.399 . . . . 75.14 111.001 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.72 -47.8 82.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 63.3 110.14 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -56.88 -43.88 81.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.151 -0.477 . . . . 75.54 111.297 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.96 -48.18 79.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.882 -0.599 . . . . 74.33 110.989 -177.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.453 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 81.3 mtp -67.46 -38.69 84.83 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.872 -0.331 . . . . 72.21 111.153 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.46 -44.48 84.76 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.516 -0.179 . . . . 72.22 110.516 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.12 -43.34 82.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.891 0.377 . . . . 73.01 110.683 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -63.21 -43.33 98.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.051 177.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 24' ' ' MET . 92.7 mt -69.72 -34.36 73.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.932 -0.576 . . . . 74.12 111.112 -178.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 -60.67 -38.94 86.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.06 0.457 . . . . 74.45 110.576 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.1 t -70.13 -43.83 78.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.853 -0.612 . . . . 74.23 110.638 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -33.23 74.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.378 -0.374 . . . . 62.42 110.741 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -59.93 -23.92 63.92 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.746 0.308 . . . . 72.03 111.529 176.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -76.68 -17.69 58.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.103 0.478 . . . . 74.35 110.996 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -103.69 -43.14 5.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.699 -0.682 . . . . 74.31 110.423 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.528 ' HB3' HD11 ' A' ' 84' ' ' LEU . 20.0 m -142.94 119.88 11.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.217 -0.901 . . . . 72.43 109.452 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -78.22 131.77 37.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.345 . . . . 75.34 110.913 -177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.645 ' CD1' HD13 ' A' ' 10' ' ' LEU . 6.7 p90 -144.82 16.66 1.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.905 -0.588 . . . . 75.04 111.482 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 58.58 -175.32 0.09 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 73.32 110.974 -177.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.7 tp -151.58 110.71 3.9 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 122.001 -0.437 . . . . 64.12 110.692 172.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.524 ' HB3' HG21 ' A' ' 11' ' ' VAL . 9.4 tp10 -104.62 141.16 36.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.043 -0.526 . . . . 74.04 109.912 176.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.4 t -127.89 117.29 45.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.454 -0.573 . . . . 74.42 109.454 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.4 mt -128.65 110.62 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.429 . . . . 65.32 111.657 -176.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.4 m120 -68.54 107.41 2.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.896 -0.593 . . . . 64.52 110.007 171.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.5 pt -82.79 -7.52 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.09 -0.505 . . . . 72.35 111.089 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -59.13 -35.62 73.79 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.429 0.456 . . . . 64.33 111.031 -174.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -82.22 -12.38 80.85 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.574 -0.822 . . . . 74.05 112.873 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -103.9 110.14 22.16 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.073 0.464 . . . . 75.11 110.323 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -59.08 -44.36 91.87 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.48 -0.782 . . . . 71.32 111.12 -175.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -69.37 -34.96 75.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.578 -0.283 . . . . 74.04 111.442 -175.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.19 -34.71 66.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.88 0.372 . . . . 75.54 110.603 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.7 m -63.35 -31.19 72.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 74.23 110.702 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 52' ' ' ARG . 14.0 mmm-85 -57.67 -35.8 71.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.368 0.604 . . . . 74.23 110.823 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.8 mt -89.54 -50.14 6.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.498 -0.773 . . . . 64.42 112.401 -175.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.562 ' O ' HG11 ' A' ' 58' ' ' VAL . 20.0 m-85 -108.82 3.97 23.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.332 0.864 . . . . 73.3 113.332 -165.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -43.2 -56.75 3.29 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.237 0.828 . . . . 71.32 113.237 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -98.18 1.46 47.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.002 0.371 . . . . 74.3 112.002 -173.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.459 ' O ' HG23 ' A' ' 60' ' ' VAL . 96.5 mtt180 -132.96 55.12 1.91 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 75.51 108.897 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.767 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -80.37 -135.07 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 118.825 -0.607 . . . . 74.24 111.978 -172.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.767 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 39.5 Cg_exo -5.45 68.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.476 0 C-N-CA 122.73 2.287 . . . . 70.31 113.474 -139.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -91.09 127.21 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 CA-C-N 115.649 -0.705 . . . . 64.13 110.104 -171.143 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.565 HD22 HG23 ' A' ' 12' ' ' VAL . 2.7 tm? -93.0 107.3 19.11 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.675 -0.693 . . . . 74.35 109.577 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 83.6 t80 -98.71 138.22 36.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.077 -0.965 . . . . 71.52 111.305 -173.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.01 112.08 21.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.854 -0.612 . . . . 73.41 110.561 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.569 ' CG2' HG23 ' A' ' 11' ' ' VAL . 38.4 t -73.64 155.0 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.076 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 79.02 -49.0 0.43 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.913 0.885 . . . . 73.54 111.718 177.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -87.88 -20.45 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.734 0.302 . . . . 64.14 110.778 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.498 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 m-20 63.02 82.18 0.19 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.857 -0.611 . . . . 72.13 112.305 175.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? -167.17 139.91 3.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.641 -0.709 . . . . 64.13 110.19 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.34 126.2 30.56 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.153 -0.684 . . . . 72.45 109.153 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.458 ' HB3' HG13 ' A' ' 79' ' ' VAL . 83.6 mt -94.76 -79.21 0.43 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.397 0.618 . . . . 74.21 110.644 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.788 ' HG ' ' HB ' ' A' ' 79' ' ' VAL . 67.3 m -107.78 177.28 4.87 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.358 -0.837 . . . . 71.52 110.281 -175.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 6.6 p80 -131.78 -170.84 2.47 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.298 -0.63 . . . . 74.0 109.298 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.462 ' HD2' ' HD2' ' A' ' 74' ' ' PHE . 34.4 p90 -44.54 132.65 6.12 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 123.737 0.648 . . . . 74.52 110.204 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.462 ' HD2' ' HD2' ' A' ' 73' ' ' TYR . 93.1 m-85 70.78 103.35 0.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 O-C-N 124.026 0.829 . . . . 74.13 109.673 -171.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.5 tp -53.77 121.71 8.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.157 -0.929 . . . . 63.32 111.789 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -76.83 -22.78 53.09 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.993 -0.549 . . . . 72.3 110.264 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 71.27 -60.4 0.52 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.929 0.892 . . . . 73.52 112.923 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -57.33 -43.77 83.67 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.893 0.378 . . . . 73.22 111.427 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.788 ' HB ' ' HG ' ' A' ' 71' ' ' CYS . 83.5 t -66.61 -42.1 89.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.922 -0.581 . . . . 74.32 111.852 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.76 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -71.69 -36.25 58.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 120.085 -0.646 . . . . 74.45 110.244 177.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -58.9 -36.07 85.91 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.469 -0.872 . . . . 71.23 111.39 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.529 0.332 . . . . 63.13 111.265 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -88.08 -36.38 16.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.954 0.407 . . . . 74.23 111.306 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.76 HD23 HD11 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -81.52 14.31 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 72.42 111.914 -175.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 1.001 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 30.7 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.132 -0.485 . . . . 74.41 109.801 174.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 . . . . . 0 N--CA 1.448 -0.567 0 CA-C-O 120.766 0.317 . . . . 75.14 110.33 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.84 -179.77 5.07 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.925 2.417 . . . . 72.11 111.722 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.419 ' HB3' ' OH ' ' A' ' 83' ' ' TYR . 25.9 mmt180 -97.07 -42.64 7.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.089 -0.505 . . . . 74.12 110.18 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.629 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.2 tmtp? 72.03 113.66 0.06 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.011 -0.995 . . . . 74.43 110.873 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 80' ' ' ILE . 44.7 mt -106.86 131.56 53.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.509 -0.769 . . . . 73.12 111.014 177.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.4 t -106.79 130.2 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 75.41 109.68 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.816 HG21 HD22 ' A' ' 61' ' ' LEU . 46.5 t -108.46 108.13 24.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 116.006 -0.543 . . . . 74.2 109.816 177.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.461 ' CB ' HG21 ' A' ' 60' ' ' VAL . 79.2 m-85 -76.22 118.25 18.75 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.965 -0.754 . . . . 72.41 108.965 175.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.87 -161.98 8.98 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.519 -0.848 . . . . 71.4 112.18 -176.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -162.65 -176.52 5.04 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.455 -0.572 . . . . 73.13 109.455 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.25 108.89 2.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.541 -0.3 . . . . 70.21 110.535 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 -144.93 16.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 121.087 -0.578 . . . . 73.22 112.067 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.8 m 70.69 95.76 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.056 0.542 . . . . 63.21 111.883 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.78 -39.59 81.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.633 -0.712 . . . . 72.31 109.897 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.531 HD22 ' OE2' ' A' ' 23' ' ' GLU . 64.6 mt -62.97 -30.94 71.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 74.52 111.794 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.89 -44.28 91.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 64.02 110.561 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -61.71 -43.01 99.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 60.05 110.279 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.531 ' OE2' HD22 ' A' ' 20' ' ' LEU . 39.0 mt-10 -66.0 -39.37 90.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.502 -0.772 . . . . 75.21 110.836 -178.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.408 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 11.6 mtt -61.25 -50.46 72.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 74.23 111.119 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.2 mt -57.21 -46.56 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.374 -0.376 . . . . 64.32 111.19 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.69 -32.58 73.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.914 0.388 . . . . 70.15 111.158 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -72.66 -45.52 58.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.765 -0.652 . . . . 54.44 110.875 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 24' ' ' MET . 96.9 mt -66.39 -32.37 73.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.927 -0.579 . . . . 75.33 111.233 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -56.73 -42.55 79.45 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.959 0.409 . . . . 74.11 110.91 176.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.14 -40.63 85.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.901 -0.591 . . . . 71.04 110.998 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.452 HD21 ' HA ' ' A' ' 31' ' ' LEU . 7.1 mt -70.06 -33.47 71.97 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.013 -0.275 . . . . 74.51 111.479 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -58.75 -21.15 54.73 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.853 0.359 . . . . 75.44 111.327 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -77.98 -15.48 58.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.423 . . . . 74.42 111.653 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.1 -43.91 4.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.542 0.687 . . . . 73.44 109.445 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.51 ' HB3' HD12 ' A' ' 84' ' ' LEU . 47.3 m -138.51 109.14 6.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.234 -0.894 . . . . 71.43 109.928 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -73.0 126.08 29.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.089 0.471 . . . . 74.33 110.963 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.629 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 4.7 p90 -136.04 18.75 3.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.022 -0.535 . . . . 74.31 111.368 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 59.92 175.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.532 0.682 . . . . 71.23 111.302 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.5 tp -151.26 109.79 3.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.009 -0.541 . . . . 74.12 110.606 173.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -121.22 117.79 27.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 63.33 109.868 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.55 115.26 48.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 109.764 -0.458 . . . . 75.45 109.764 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.2 mt -114.59 122.27 68.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.244 -0.435 . . . . 74.12 111.071 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.46 111.36 4.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.794 -0.639 . . . . 72.32 111.275 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.4 pt -81.0 -21.62 11.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.865 -0.421 . . . . 75.42 109.865 176.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -63.63 -18.95 64.47 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.901 -0.59 . . . . 74.34 111.476 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.87 9.14 59.94 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.691 -0.766 . . . . 62.22 112.253 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -133.09 113.11 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.743 0.306 . . . . 74.4 110.395 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.4 -42.6 87.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 64.23 111.248 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -60.5 -41.5 94.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.888 0.375 . . . . 74.31 110.678 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 53' ' ' LEU . 77.1 mt -77.23 -32.09 55.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 64.34 111.019 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 72.5 m -67.86 -25.63 65.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.316 0.579 . . . . 74.33 110.362 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 53.1 mmt-85 -78.44 -35.12 47.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 70.25 110.143 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.488 HD13 HD22 ' A' ' 50' ' ' LEU . 81.8 mt -70.76 -55.4 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 70.41 111.132 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -108.42 -67.68 0.96 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.006 -0.543 . . . . 71.41 112.065 -170.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 50.86 -87.38 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.984 0.803 . . . . 73.14 111.977 -170.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -89.38 21.86 3.16 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.398 0.618 . . . . 71.33 110.662 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -130.55 59.73 1.65 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.345 -0.843 . . . . 73.0 108.839 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.74 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -92.0 -127.1 0.0 OUTLIER Pre-proline 0 N--CA 1.431 -1.388 0 CA-C-O 117.823 -1.084 . . . . 75.13 109.735 -178.578 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.74 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 80.4 Cg_exo -12.96 71.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 122.504 2.136 . . . . 73.42 114.069 -143.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.461 HG21 ' CB ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -102.11 118.97 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.323 -0.853 . . . . 73.25 111.456 -170.326 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.816 HD22 HG21 ' A' ' 12' ' ' VAL . 50.8 mt -83.05 103.24 12.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.066 -0.515 . . . . 75.33 110.501 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -91.52 119.39 31.42 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.371 -0.831 . . . . 73.42 109.709 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.03 103.68 5.31 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.506 -0.77 . . . . 71.32 110.523 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.405 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 61.0 t -74.61 150.12 7.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 108.977 -0.749 . . . . 71.53 108.977 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.0 t30 67.04 21.94 10.09 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.839 0.828 . . . . 73.24 109.696 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.465 ' HG3' ' HE1' ' A' ' 83' ' ' TYR . 1.0 OUTLIER -152.56 -44.41 0.1 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.31 -0.859 . . . . 75.11 109.091 -178.587 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.7 t70 70.89 81.41 0.16 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.944 -1.025 . . . . 71.13 111.355 176.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -176.34 164.25 2.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.472 -0.786 . . . . 73.33 109.82 175.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -91.66 129.82 37.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.315 -0.402 . . . . 73.01 109.98 172.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.0 mt -84.29 -49.58 8.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.168 -0.678 . . . . 75.03 109.168 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 14.5 t -170.99 167.91 7.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.395 -0.965 . . . . 61.51 108.395 177.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.406 ' HB3' ' CG1' ' A' ' 60' ' ' VAL . 1.7 p-80 -143.96 147.2 33.6 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.152 -0.219 . . . . 65.32 111.204 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 74.97 -44.95 0.56 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 124.174 0.921 . . . . 74.23 111.967 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -125.21 163.74 21.81 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.339 -0.615 . . . . 71.52 109.339 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.7 tp -113.64 101.2 9.1 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.368 -0.378 . . . . 71.14 111.566 -168.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -80.98 93.01 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.738 -0.467 . . . . 71.55 109.738 172.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.48 ' HA ' HG21 ' A' ' 80' ' ' ILE . 14.1 m -56.25 -34.42 66.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.84 -0.618 . . . . 75.33 110.574 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -58.82 -40.59 84.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.545 -0.752 . . . . 73.41 111.134 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 91.2 t -76.8 -49.26 24.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.131 -0.486 . . . . 73.41 111.716 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.484 HD12 HD22 ' A' ' 84' ' ' LEU . 7.2 tp -63.36 -35.24 71.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 120.737 -0.385 . . . . 74.51 110.694 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.25 -36.19 91.4 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.89 -0.671 . . . . 63.35 111.708 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.16 75.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 73.33 110.751 177.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.465 ' HE1' ' HG3' ' A' ' 66' ' ' GLU . 40.3 t80 -87.18 -50.09 6.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.837 -0.619 . . . . 74.1 111.839 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.51 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -63.58 -45.56 89.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.289 -0.414 . . . . 74.32 111.503 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 C--N 1.32 -0.715 0 CA-C-N 116.325 -0.398 . . . . 75.13 110.762 -177.371 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.444 -0.762 0 N-CA-C 109.477 -0.564 . . . . 75.14 109.477 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -89.37 -170.75 0.47 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.285 2.657 . . . . 54.42 112.889 -172.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.433 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 22.7 mmt180 -103.99 164.87 11.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.634 -0.712 . . . . 70.3 109.576 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.1 tmtp? -141.23 129.52 22.32 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.7 -0.481 . . . . 72.44 109.7 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.496 HD12 ' CD1' ' A' ' 80' ' ' ILE . 57.9 mt -113.84 139.85 48.82 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.079 -0.51 . . . . 71.43 111.598 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.532 HG23 ' CG2' ' A' ' 64' ' ' VAL . 53.3 t -112.26 129.57 67.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.63 -0.714 . . . . 74.43 109.336 170.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.635 HG21 HD21 ' A' ' 61' ' ' LEU . 39.2 t -99.11 114.25 36.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.752 -0.462 . . . . 73.24 109.752 174.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -89.62 126.01 35.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.928 -0.578 . . . . 74.42 110.464 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.05 -163.34 12.93 Favored Glycine 0 N--CA 1.443 -0.862 0 C-N-CA 120.737 -0.744 . . . . 63.44 111.714 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -149.34 160.54 43.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.195 -0.298 . . . . 75.34 110.195 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -62.45 110.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.237 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.4 -19.6 4.53 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.531 -0.842 . . . . 53.04 112.463 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.7 m -74.39 85.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.894 0.378 . . . . 73.53 110.539 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -70.86 -30.82 67.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 73.2 110.354 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -60.31 -32.12 70.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.775 -0.648 . . . . 72.51 109.779 176.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.9 t -67.76 -38.7 83.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 63.14 110.265 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' ILE . 50.6 mt-10 -68.0 -32.59 73.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.639 -0.71 . . . . 64.42 110.51 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.89 -39.33 94.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.933 -0.576 . . . . 73.43 110.079 174.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.672 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 78.6 mtp -69.33 -27.29 65.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.562 -0.744 . . . . 74.11 110.936 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 22' ' ' GLU . 74.0 mt -57.01 -43.41 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.462 -0.335 . . . . 73.53 110.17 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.46 97.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 72.23 110.665 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.9 m -60.18 -47.98 83.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.73 -0.668 . . . . 73.54 110.668 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 88.5 mt -62.37 -43.13 99.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.795 -0.639 . . . . 73.43 111.009 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -55.48 -43.48 75.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 74.23 111.575 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.0 t -65.46 -40.96 89.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.495 -0.321 . . . . 74.54 110.685 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.428 HD21 ' HA ' ' A' ' 31' ' ' LEU . 2.2 mt -66.76 -35.14 79.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.637 -0.256 . . . . 71.11 111.014 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 98.9 mt-30 -60.58 -21.38 62.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 63.01 111.503 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -78.05 -13.43 59.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.3 110.799 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -42.23 5.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.96 -0.563 . . . . 70.32 109.985 175.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.509 ' HB3' HD12 ' A' ' 84' ' ' LEU . 31.8 m -141.02 121.03 13.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.448 -0.796 . . . . 74.01 109.869 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -85.45 125.15 32.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.057 0.456 . . . . 74.12 111.199 -175.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HB3' HD13 ' A' ' 84' ' ' LEU . 10.5 p90 -133.46 17.07 4.01 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.723 -0.671 . . . . 74.33 111.291 178.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 58.67 -178.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.418 0.627 . . . . 74.12 111.313 -176.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tp -151.25 109.93 3.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.033 -0.531 . . . . 65.04 110.456 173.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -108.76 143.82 37.39 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.512 -0.551 . . . . 74.0 109.512 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.89 108.07 17.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.587 -0.523 . . . . 70.53 109.587 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.405 HD12 HG11 ' A' ' 11' ' ' VAL . 59.5 mt -118.78 118.45 57.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.082 0.468 . . . . 74.44 111.079 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -78.07 115.74 18.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.735 -0.666 . . . . 75.1 109.818 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.57 HG22 ' HB3' ' A' ' 50' ' ' LEU . 26.7 pt -71.74 -34.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.111 -0.495 . . . . 74.01 111.458 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.88 98.1 0.26 Allowed 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.37 0.605 . . . . 65.42 110.768 178.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 146.72 -37.79 1.17 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.053 -1.219 . . . . 74.01 110.053 -176.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -97.65 109.02 21.86 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.527 -0.916 . . . . 74.41 108.527 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -50.62 -34.96 28.17 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 123.878 0.736 . . . . 75.32 111.383 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.71 -49.97 19.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.396 -0.366 . . . . 75.21 110.756 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.57 ' HB3' HG22 ' A' ' 44' ' ' ILE . 32.9 mt -66.42 -34.45 77.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.795 -0.184 . . . . 74.43 111.36 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.1 m -57.78 -56.41 22.27 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.892 -0.323 . . . . 61.23 110.163 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HD3' ' HA ' ' A' ' 52' ' ' ARG . 35.0 mmt180 -63.78 -31.55 72.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.594 0.235 . . . . 73.52 111.54 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.0 mt -69.89 -47.15 63.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.4 0.518 . . . . 74.34 112.4 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 58' ' ' VAL . 96.9 m-85 -117.4 -9.56 10.87 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.33 1.233 . . . . 73.55 114.33 -167.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -76.84 82.97 3.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 119.078 0.854 . . . . 74.32 109.658 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.559 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 16.2 t70 -154.34 -59.42 0.12 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.633 -1.167 . . . . 74.51 109.075 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 56' ' ' ASP . 46.7 mtm180 -157.91 90.33 1.06 Allowed 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.28 -1.748 . . . . 75.23 106.28 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.466 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.12 -107.06 0.0 OUTLIER Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 113.473 0.916 . . . . 71.54 113.473 -161.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.466 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 96.4 Cg_exo -9.62 72.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.695 0 C-N-CA 122.709 2.272 . . . . 75.33 113.873 -140.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -98.28 135.23 33.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.322 -0.854 . . . . 75.23 110.968 -168.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.635 HD21 HG21 ' A' ' 12' ' ' VAL . 34.9 mt -93.52 107.83 19.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 72.13 110.796 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -92.45 123.6 35.87 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.636 -0.711 . . . . 73.23 110.519 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.8 107.14 7.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.803 -0.635 . . . . 74.44 109.553 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.532 ' CG2' HG23 ' A' ' 11' ' ' VAL . 92.3 t -69.78 -31.33 48.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.924 0.392 . . . . 74.02 111.661 -174.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.85 -44.73 16.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.139 0.495 . . . . 75.44 110.67 -178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.424 ' CG ' ' HE3' ' A' ' 68' ' ' LYS . 3.5 tp10 -85.55 -20.94 28.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 111.138 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 62.23 74.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.664 -0.698 . . . . 75.23 110.56 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HE3' ' CG ' ' A' ' 66' ' ' GLU . 19.6 ptpt -172.55 158.08 4.09 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.656 -0.702 . . . . 74.42 110.061 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -84.4 118.79 24.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.0 -0.371 . . . . 72.1 110.0 173.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 82.8 mt -88.01 -68.53 0.75 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.602 0.715 . . . . 65.51 110.788 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 85.6 m -119.21 170.74 8.82 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.697 -1.138 . . . . 65.13 110.41 -173.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -132.65 -172.23 2.86 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.704 -0.68 . . . . 74.01 109.645 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.672 ' HA ' ' SD ' ' A' ' 24' ' ' MET . 21.6 p90 -52.45 138.31 27.7 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.71 -0.478 . . . . 74.01 109.71 175.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.417 ' HD1' ' CD2' ' A' ' 73' ' ' TYR . 82.4 m-85 70.67 98.59 0.06 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.957 0.786 . . . . 75.23 108.978 -167.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 tp -52.39 119.93 4.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.684 -1.144 . . . . 61.42 112.454 -170.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.21 -31.46 72.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.919 -0.582 . . . . 74.34 109.712 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.2 m 72.91 -54.63 0.69 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.118 -0.946 . . . . 73.4 112.834 172.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -74.63 -48.75 24.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.524 0.202 . . . . 72.44 111.504 -175.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 15.4 t -56.32 -49.35 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 112.412 0.523 . . . . 71.12 112.412 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.632 HD13 HD21 ' A' ' 84' ' ' LEU . 5.7 tp -64.6 -30.93 51.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 C-N-CA 120.302 -0.559 . . . . 72.34 110.507 177.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.82 -37.04 93.66 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.83 -0.7 . . . . 73.55 112.021 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.68 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.39 0.614 . . . . 71.21 111.019 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -84.35 -36.18 22.69 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 70.43 110.798 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.632 HD21 HD13 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -87.84 13.54 10.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.807 -0.633 . . . . 74.5 111.759 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.443 -0.344 . . . . 74.12 110.129 175.861 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.535 -0.172 . . . . 72.33 110.535 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -80.96 166.54 18.87 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.467 2.112 . . . . 74.55 112.544 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -95.22 171.68 8.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.968 -0.56 . . . . 72.02 109.882 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 45.8 mtpt -126.56 146.99 49.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.834 0.35 . . . . 75.41 110.829 175.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.487 HD13 HD11 ' A' ' 80' ' ' ILE . 84.1 mt -120.42 128.24 53.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.814 -0.63 . . . . 75.22 110.1 174.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.514 HG22 ' HB3' ' A' ' 40' ' ' GLU . 55.4 t -108.5 127.41 64.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.896 -0.593 . . . . 62.22 110.305 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.695 HG23 HD22 ' A' ' 61' ' ' LEU . 86.0 t -98.94 108.2 21.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.772 -0.649 . . . . 74.43 109.276 174.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.552 ' CB ' HG23 ' A' ' 60' ' ' VAL . 19.0 m-85 -77.93 107.76 10.69 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.576 -0.45 . . . . 64.25 109.886 176.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -130.72 -145.51 5.71 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.946 -0.861 . . . . 70.22 110.946 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -174.78 110.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.878 0.339 . . . . 75.41 111.241 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 65.06 -87.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.663 -0.699 . . . . 75.32 111.727 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.46 134.52 5.21 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 121.03 -0.605 . . . . 74.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.565 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 44.1 t -153.29 141.29 20.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.918 -0.401 . . . . 74.43 109.918 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -60.22 -34.64 73.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 72.04 110.922 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.561 ' HG ' ' HD1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -73.72 -32.95 64.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.535 . . . . 71.11 111.243 -177.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 70.7 m -64.28 -42.19 96.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.472 -0.331 . . . . 70.1 110.455 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -54.4 -38.25 65.98 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.222 0.534 . . . . 71.14 110.437 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -74.75 -48.38 25.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.665 -0.698 . . . . 71.44 111.345 -176.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 87.3 mtp -67.13 -42.95 83.57 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.112 -0.235 . . . . 75.01 111.282 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.8 mt -58.74 -48.28 86.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.401 0.143 . . . . 64.13 110.926 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.952 0.406 . . . . 63.43 110.892 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 m -62.91 -43.89 97.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.795 -0.639 . . . . 64.53 111.074 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 92.9 mt -69.03 -35.25 76.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.31 -0.404 . . . . 74.23 111.373 -178.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.6 mmm180 -57.77 -40.95 80.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.858 0.361 . . . . 62.0 110.864 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.5 t -67.31 -40.12 84.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 74.1 110.867 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.33 -32.06 72.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.69 -0.232 . . . . 75.43 111.23 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 95.3 mt-30 -57.65 -23.01 48.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 72.33 111.339 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -76.58 -19.18 58.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.143 -0.481 . . . . 74.33 111.177 -177.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -105.46 -40.25 5.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.124 0.488 . . . . 75.03 110.545 176.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.531 ' HB3' HD11 ' A' ' 84' ' ' LEU . 19.6 m -140.92 120.38 13.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.915 -0.584 . . . . 73.43 109.756 -178.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.7 t-105 -83.81 123.98 30.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.116 0.484 . . . . 71.14 111.159 -176.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.56 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 5.6 p90 -134.88 19.07 3.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.487 -0.779 . . . . 73.23 110.519 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 59.01 -178.23 0.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.923 -0.58 . . . . 75.12 110.302 -176.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.6 tp -151.95 108.71 3.49 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.619 -0.512 . . . . 75.41 109.619 170.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' HB3' HG22 ' A' ' 11' ' ' VAL . 19.4 tt0 -120.28 117.9 29.03 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.569 -0.741 . . . . 71.15 109.473 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.06 108.6 25.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 73.54 109.534 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 13' ' ' TYR . 70.3 mt -110.12 118.01 56.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.92 -0.582 . . . . 72.44 110.001 -177.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 87.4 m-20 -70.19 138.08 51.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.953 -0.567 . . . . 70.13 110.51 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.8 pt -65.89 -25.74 36.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 169.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 43' ' ' ASN . 10.6 t70 -57.11 112.01 1.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.589 -1.187 . . . . 63.01 109.548 170.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 120.42 -25.91 7.17 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.049 -0.82 . . . . 62.21 111.049 -174.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -118.57 106.86 13.07 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.595 -0.52 . . . . 71.21 109.595 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.48 -33.79 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.216 -0.447 . . . . 74.32 111.176 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -69.17 -35.57 76.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.453 -0.339 . . . . 74.24 110.516 -176.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.467 ' HB3' HG21 ' A' ' 44' ' ' ILE . 71.5 mt -73.36 -44.28 59.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 75.01 110.887 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.531 ' HA ' HD12 ' A' ' 44' ' ' ILE . 38.4 m -65.97 -25.24 67.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.037 0.446 . . . . 71.34 110.921 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -38.54 89.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.321 0.581 . . . . 70.45 110.099 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 75.8 mt -90.43 -52.89 4.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.383 -0.826 . . . . 73.2 111.463 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -102.74 21.0 16.23 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.758 0.651 . . . . 72.31 112.758 -167.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -50.81 -44.24 59.03 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.774 0.321 . . . . 75.21 111.191 176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -124.27 24.96 7.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.218 1.009 . . . . 74.4 109.271 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -136.32 36.97 2.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.419 -0.956 . . . . 72.33 108.419 -178.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.567 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -83.16 -108.09 0.0 OUTLIER Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.37 -0.824 . . . . 50.13 110.56 -173.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.567 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 31.0 Cg_exo -15.01 68.01 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.481 0 C-N-CA 122.622 2.214 . . . . 74.54 114.124 -144.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.703 HG13 ' HB3' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -98.99 115.78 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 114.933 -1.03 . . . . 75.11 110.497 -172.323 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.695 HD22 HG23 ' A' ' 12' ' ' VAL . 2.4 tm? -86.64 105.13 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.584 -0.734 . . . . 72.23 109.528 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -92.28 129.46 38.22 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.959 -1.019 . . . . 75.43 110.58 -176.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -84.79 105.74 15.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.521 -0.763 . . . . 73.13 110.683 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.449 HG22 HG21 ' A' ' 11' ' ' VAL . 24.9 t -79.35 84.09 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 74.04 110.586 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 176.23 -54.46 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.992 -1.004 . . . . 53.2 109.248 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -98.0 -12.82 21.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.067 -0.969 . . . . 72.13 111.007 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 61.8 78.1 0.3 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.89 -0.595 . . . . 70.25 109.799 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.58 163.92 6.72 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.515 -0.766 . . . . 75.42 110.213 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -84.58 142.95 29.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.341 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.6 mt -99.88 -32.71 10.86 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.506 -0.553 . . . . 71.21 109.506 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.8 t -173.7 151.74 1.92 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.176 -0.92 . . . . 74.33 109.244 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.703 ' HB3' HG13 ' A' ' 60' ' ' VAL . 2.6 p-80 -135.24 129.96 34.47 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.716 -0.476 . . . . 75.32 109.716 173.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.561 ' HD1' ' HG ' ' A' ' 20' ' ' LEU . 96.8 m-85 66.71 122.15 0.02 OUTLIER 'General case' 0 C--O 1.235 0.341 0 O-C-N 124.239 0.962 . . . . 75.25 110.728 -170.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.4 ' H ' ' CD1' ' A' ' 20' ' ' LEU . 84.5 m-85 65.67 -160.85 0.27 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.077 -1.419 . . . . 74.13 109.603 -176.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.5 tp -136.98 117.34 13.64 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 120.088 -0.645 . . . . 71.45 111.761 -172.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -86.86 87.65 7.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.135 -0.484 . . . . 65.11 109.741 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 m -59.33 -32.3 69.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.809 -0.632 . . . . 74.42 110.753 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -59.16 -43.39 92.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.837 -0.62 . . . . 74.51 111.169 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.4 t -75.33 -46.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 72.53 111.562 -176.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.764 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.99 -30.91 48.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.257 -0.577 . . . . 73.25 110.323 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.23 -29.52 75.51 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.561 -0.828 . . . . 63.33 111.524 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.98 -26.54 36.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.089 0.471 . . . . 73.41 110.508 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -87.46 -52.55 5.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 74.51 112.157 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.764 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.231 -0.44 . . . . 63.43 111.461 -170.169 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 75.32 110.188 177.04 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 109.682 -0.488 . . . . 75.41 109.682 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.8 122.81 5.55 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.401 2.067 . . . . 74.32 111.569 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.35 105.08 13.96 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 72.35 110.318 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 10' ' ' LEU . 1.9 tmtp? -71.47 146.33 48.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.063 -0.971 . . . . 74.04 110.247 -173.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.64 HD11 ' CD1' ' A' ' 37' ' ' PHE . 98.5 mt -124.48 136.85 54.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.073 0.464 . . . . 74.34 111.347 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.69 HG22 HG21 ' A' ' 64' ' ' VAL . 39.3 t -114.48 135.72 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.89 -0.595 . . . . 75.32 110.17 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.679 HG23 HD21 ' A' ' 61' ' ' LEU . 98.5 t -107.54 106.84 21.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.565 -0.531 . . . . 74.42 109.565 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.443 ' CB ' HG21 ' A' ' 60' ' ' VAL . 89.7 m-85 -76.99 122.98 25.67 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.764 -0.828 . . . . 74.42 108.764 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -157.51 -169.26 21.06 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 119.503 -1.332 . . . . 64.53 112.922 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -154.6 144.58 21.77 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.848 -0.797 . . . . 73.22 108.848 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -75.83 87.92 2.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.046 0.451 . . . . 75.33 110.037 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.08 32.1 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.551 -0.749 . . . . 60.25 111.511 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 p -170.58 138.99 1.53 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.69 -0.485 . . . . 74.31 109.69 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -70.68 -29.89 66.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 74.5 112.127 -172.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.441 HD12 ' CD1' ' A' ' 73' ' ' TYR . 26.4 mt -55.78 -30.4 61.23 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.489 0.551 . . . . 72.12 112.489 -175.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.461 ' O ' HG13 ' A' ' 25' ' ' ILE . 76.1 m -54.5 -50.5 67.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.327 . . . . 75.01 110.863 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.75 -35.59 81.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.115 -0.493 . . . . 65.41 110.834 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -68.76 -44.1 74.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.669 -0.696 . . . . 71.53 111.309 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.6 mtp -65.65 -37.53 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.925 -0.31 . . . . 75.31 111.157 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.0 mt -57.71 -52.38 58.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 110.143 -0.317 . . . . 71.13 110.143 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.44 89.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 64.24 110.879 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.8 m -59.15 -42.87 91.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.92 -0.582 . . . . 73.04 111.106 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.2 mt -68.45 -42.53 78.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 73.14 111.046 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -60.84 -26.44 67.35 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.97 0.359 . . . . 74.11 111.97 -175.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.79 -44.83 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.654 0.264 . . . . 75.52 110.602 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.87 -26.01 53.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.343 0.592 . . . . 74.13 109.82 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.403 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . 41.4 tt0 -60.98 -20.54 62.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.4 -0.818 . . . . 72.12 110.366 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -71.95 -16.83 62.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.828 -0.624 . . . . 75.04 111.514 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.35 -39.02 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.49 -0.323 . . . . 73.31 111.153 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.2 m -126.97 135.98 51.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.505 -0.316 . . . . 64.0 111.056 -174.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -84.13 110.93 18.88 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.224 -0.443 . . . . 73.0 110.478 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.874 ' HB3' HD12 ' A' ' 84' ' ' LEU . 32.4 p90 -132.57 6.18 4.06 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.93 -0.577 . . . . 72.04 110.744 176.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 59.77 -177.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.675 . . . . 64.32 111.546 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -149.19 120.02 7.59 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.994 -0.548 . . . . 63.05 110.017 175.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.527 ' HB3' HG23 ' A' ' 11' ' ' VAL . 23.3 tt0 -131.29 118.03 19.78 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.822 -0.436 . . . . 72.1 109.822 177.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -103.9 114.24 42.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 109.543 -0.54 . . . . 64.2 109.543 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 62.6 mt -112.62 116.89 53.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.256 0.55 . . . . 74.43 111.04 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -71.75 107.45 4.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 71.1 110.582 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 29.7 pt -76.34 -10.73 13.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.286 0.565 . . . . 75.34 109.62 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -46.81 -39.2 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.421 -1.263 . . . . 74.24 112.651 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.5 20.99 48.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.526 -0.845 . . . . 75.25 112.9 -176.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -137.26 110.36 7.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.882 0.341 . . . . 71.5 110.564 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -59.02 -33.78 71.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.334 -0.394 . . . . 63.35 111.807 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -66.21 -52.19 50.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 73.45 110.404 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.35 -38.97 88.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.87 -0.604 . . . . 73.43 110.958 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.9 m -62.05 -40.97 97.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.872 0.367 . . . . 74.44 111.243 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 70.1 mtp85 -75.53 -31.98 60.3 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 122.077 -0.39 . . . . 74.43 110.576 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -64.12 -51.43 64.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 73.03 110.978 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -109.61 -72.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.067 -0.515 . . . . 73.12 111.596 -173.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 51.02 -81.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.691 0.797 . . . . 64.21 111.725 -169.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -91.23 8.6 35.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.686 0.755 . . . . 71.22 110.104 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.11 46.89 1.1 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.203 -0.666 . . . . 74.42 109.203 169.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.796 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -81.86 -142.24 0.0 OUTLIER Pre-proline 0 N--CA 1.447 -0.6 0 CA-C-O 118.578 -0.725 . . . . 72.25 110.653 -178.781 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.796 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 82.7 Cg_exo -8.01 71.38 0.0 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.885 0 C-N-CA 122.663 2.242 . . . . 73.13 113.885 -139.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.443 HG21 ' CB ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.77 113.48 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.453 -0.794 . . . . 61.32 110.136 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.679 HD21 HG23 ' A' ' 12' ' ' VAL . 2.5 tm? -83.37 106.75 15.38 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.765 -0.652 . . . . 74.2 109.355 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -100.57 134.4 43.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.82 -1.082 . . . . 75.44 110.797 -175.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.507 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -84.91 106.19 16.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.841 -0.618 . . . . 75.41 110.943 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.69 HG21 HG22 ' A' ' 11' ' ' VAL . 49.1 t -86.31 91.93 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.937 0.399 . . . . 72.11 111.067 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 168.97 -57.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.666 -1.152 . . . . 75.51 108.21 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -91.21 -18.87 23.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.549 -0.75 . . . . 73.24 110.499 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.1 t70 68.05 87.02 0.13 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.689 -0.687 . . . . 71.24 110.002 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.507 ' HG3' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -167.37 165.53 14.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.312 -0.858 . . . . 75.1 109.467 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -108.99 137.8 46.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.892 -0.41 . . . . 74.03 109.892 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.462 HD13 HD11 ' A' ' 61' ' ' LEU . 18.9 mt -96.79 -70.47 0.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.017 0.437 . . . . 74.0 110.869 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 21.4 p -143.91 160.63 40.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 63.14 110.189 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.528 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.8 p-80 -139.54 144.47 37.88 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.159 -0.216 . . . . 74.41 110.999 179.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.441 ' CD1' HD12 ' A' ' 20' ' ' LEU . 6.6 m-85 74.54 -43.79 0.54 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.831 0.852 . . . . 75.33 112.81 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -135.56 137.0 41.59 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.202 -0.666 . . . . 72.01 109.202 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 17.8 tp -89.71 110.71 21.58 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.049 0.452 . . . . 62.32 110.525 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -64.97 -28.41 69.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.805 -0.634 . . . . 72.35 111.087 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.0 m 75.77 -40.99 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.804 -0.635 . . . . 72.31 112.143 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -76.6 -45.97 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.071 -0.393 . . . . 72.42 110.455 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.3 t -55.31 -49.83 69.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.171 -0.468 . . . . 72.33 111.68 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.497 HD12 HD12 ' A' ' 10' ' ' LEU . 7.2 tp -66.83 -34.75 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 64.32 110.397 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.24 -22.84 77.57 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.879 -0.677 . . . . 63.52 111.972 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.16 -32.76 56.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.166 0.507 . . . . 73.34 110.173 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.466 ' CZ ' ' HB2' ' A' ' 63' ' ' ALA . 85.2 t80 -87.09 -38.97 16.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.637 -0.71 . . . . 75.54 111.804 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.874 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -79.17 4.02 16.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.637 0.606 . . . . 74.41 112.637 -171.453 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.606 -0.516 . . . . 74.01 109.606 173.293 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 108.609 -0.886 . . . . 70.21 108.609 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -76.66 158.93 35.57 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.02 1.814 . . . . 64.11 111.827 -179.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.696 ' NH2' ' O ' ' A' ' 85' ' ' SER . 44.9 mtt180 -81.21 -21.64 39.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.418 -0.356 . . . . 73.42 111.436 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.9 tmtp? 64.34 108.52 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.933 0.771 . . . . 71.43 112.828 170.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.512 HD12 ' CD1' ' A' ' 37' ' ' PHE . 32.0 mt -105.43 133.01 50.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.618 -0.719 . . . . 61.23 110.811 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.546 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.6 t -109.85 131.69 60.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.687 -0.688 . . . . 74.43 109.84 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.513 HG23 ' CD2' ' A' ' 61' ' ' LEU . 62.3 t -99.31 109.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.829 -0.434 . . . . 75.43 109.829 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.48 ' CB ' HG22 ' A' ' 60' ' ' VAL . 12.9 m-85 -84.33 120.33 26.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.138 -0.483 . . . . 71.52 110.124 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -138.87 170.5 23.99 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.157 -0.777 . . . . 63.52 111.157 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -135.72 123.66 22.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.12 0.46 . . . . 75.23 110.813 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 61.27 -81.53 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.262 0.976 . . . . 73.43 112.454 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.82 139.36 6.01 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.673 -0.775 . . . . 51.11 112.203 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.2 m -148.84 115.71 6.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.1 -0.333 . . . . 75.14 110.1 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -56.48 -46.84 80.25 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.983 0.421 . . . . 63.11 111.098 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' H ' ' A' ' 74' ' ' PHE . 1.9 tm? -63.98 -32.15 73.59 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.767 -0.651 . . . . 72.31 110.707 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.33 -38.68 85.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.535 -0.302 . . . . 70.22 110.557 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.21 -39.92 73.24 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.493 0.663 . . . . 75.4 110.22 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -69.89 -34.18 73.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.085 -0.961 . . . . 54.22 110.843 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.483 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 73.3 mtp -68.0 -42.18 81.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 74.13 109.982 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.7 mt -55.83 -46.12 79.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.748 -0.66 . . . . 73.21 110.728 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.01 98.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.509 . . . . 73.34 110.91 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 m -60.52 -39.09 86.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.291 0.567 . . . . 73.51 110.717 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.53 HD12 HD22 ' A' ' 61' ' ' LEU . 84.3 mt -71.24 -33.8 70.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.999 -0.546 . . . . 63.3 111.684 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -62.14 -40.73 96.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.362 . . . . 72.42 110.213 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 63.0 t -66.76 -43.65 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 72.13 110.858 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 31' ' ' LEU . 7.0 mt -63.03 -33.66 75.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.69 -0.232 . . . . 73.24 111.27 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.413 ' HA ' ' O ' ' A' ' 35' ' ' SER . 47.5 mt-30 -58.94 -25.27 63.35 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.876 0.324 . . . . 63.23 111.876 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -75.37 -19.39 59.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.077 0.465 . . . . 74.54 110.734 -179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -101.33 -44.68 5.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 74.4 109.689 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.521 ' HB3' HD11 ' A' ' 84' ' ' LEU . 13.5 m -139.22 120.35 14.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 64.23 109.582 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -83.61 124.01 30.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.391 0.615 . . . . 74.22 111.226 -174.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.512 ' CD1' HD12 ' A' ' 10' ' ' LEU . 4.4 p90 -135.45 13.95 3.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.864 -0.607 . . . . 75.41 111.369 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 60.44 174.45 0.1 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.465 0.65 . . . . 74.21 111.584 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.1 tp -151.32 112.76 4.38 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.133 -0.485 . . . . 74.45 110.726 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.529 ' HB3' HG22 ' A' ' 11' ' ' VAL . 28.1 tt0 -124.77 118.76 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -99.94 120.52 49.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.865 -0.421 . . . . 73.32 109.865 -177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 71.2 mt -125.82 121.13 59.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.941 0.401 . . . . 73.12 111.178 -176.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 9.3 m120 -66.62 125.7 26.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.742 -0.663 . . . . 73.15 111.162 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 50' ' ' LEU . 22.3 pt -88.12 -23.24 6.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.459 -0.337 . . . . 74.33 110.268 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -59.92 117.18 4.73 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.383 0.611 . . . . 64.43 110.429 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.24 -31.02 6.95 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.482 -0.781 . . . . 70.14 111.465 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -92.79 113.34 25.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.233 -0.654 . . . . 75.12 109.233 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -38.13 89.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.696 -0.229 . . . . 74.13 111.553 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -60.6 -51.51 69.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.28 0.562 . . . . 74.04 110.4 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.424 HD11 HG22 ' A' ' 44' ' ' ILE . 92.6 mt -67.58 -37.56 82.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.668 -0.697 . . . . 75.35 111.253 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.8 m -66.57 -43.46 84.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 75.54 110.842 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -67.28 -37.39 83.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.819 0.342 . . . . 75.4 110.293 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.2 -55.92 13.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.047 -0.524 . . . . 74.44 111.46 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.86 -66.07 0.97 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.394 -0.366 . . . . 74.22 111.529 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.92 -83.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.111 0.782 . . . . 72.44 113.111 -175.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -85.44 -16.41 39.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.983 -0.553 . . . . 72.34 111.676 -170.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.62 78.0 1.48 Allowed 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.347 -1.353 . . . . 71.13 107.347 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.518 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.28 -97.54 0.0 OUTLIER Pre-proline 0 N--CA 1.423 -1.794 0 CA-C-O 118.163 -0.922 . . . . 70.23 110.676 -175.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.518 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 85.3 Cg_exo -21.29 75.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.821 2.347 . . . . 75.25 114.154 -149.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -107.23 122.89 62.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.267 -0.879 . . . . 74.34 110.798 -170.764 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.53 HD22 HD12 ' A' ' 28' ' ' LEU . 48.1 mt -85.01 109.56 18.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.084 0.469 . . . . 72.42 110.769 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.546 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 88.1 t80 -92.46 124.11 36.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.448 -0.796 . . . . 75.34 110.691 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.83 109.17 16.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.744 . . . . 71.04 109.719 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.474 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 57.8 t -73.21 -20.53 18.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.289 -0.414 . . . . 51.42 111.794 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -51.78 18.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.951 0.352 . . . . 64.42 111.951 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -100.95 -5.19 26.27 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.823 0.344 . . . . 74.03 111.464 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 63.61 78.87 0.27 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.495 0.664 . . . . 65.25 111.344 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.98 177.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.111 -0.95 . . . . 74.51 108.82 175.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.52 156.38 17.32 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 120.905 0.383 . . . . 72.32 110.694 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -111.1 -76.32 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.621 0.724 . . . . 74.04 110.403 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 41.5 t -115.7 142.92 46.1 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.574 -1.194 . . . . 72.43 109.737 -175.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.552 ' HB3' HG13 ' A' ' 60' ' ' VAL . 17.7 p-80 -133.13 130.05 38.72 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.302 -0.408 . . . . 73.44 110.481 177.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 68.7 140.02 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.099 -0.955 . . . . 75.14 112.348 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.482 ' H ' HD13 ' A' ' 20' ' ' LEU . 98.8 m-85 58.1 -105.77 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.205 -1.361 . . . . 74.04 111.352 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 75' ' ' LEU . 12.0 tp 172.36 107.46 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 123.764 0.665 . . . . 75.24 109.537 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -71.73 -25.68 62.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 74.3 109.966 176.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.0 m 69.08 -55.03 0.56 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.116 -0.947 . . . . 65.14 112.189 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.12 -43.7 91.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.689 0.28 . . . . 71.11 111.733 -177.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.12 -46.28 94.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.476 -0.329 . . . . 71.03 111.74 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.51 ' CD1' HD13 ' A' ' 10' ' ' LEU . 6.0 tp -70.51 -33.86 55.2 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 119.989 -0.685 . . . . 65.35 109.79 176.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.63 99.69 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.797 -0.716 . . . . 61.42 111.587 176.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.95 -32.02 71.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 70.54 110.907 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.834 -0.621 . . . . 74.12 111.065 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 35' ' ' SER . 0.7 OUTLIER -92.04 13.56 18.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 73.1 111.926 -176.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.696 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 67.7 m . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 110.028 -0.36 . . . . 72.41 110.028 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.439 -0.578 . . . . 72.44 109.439 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 162.92 40.67 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.118 1.879 . . . . 74.34 111.461 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -101.52 173.27 6.51 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.366 -0.379 . . . . 75.23 110.482 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 19.8 mtpt -135.05 126.6 28.78 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.975 -0.557 . . . . 74.41 109.946 174.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.443 HD13 HD11 ' A' ' 80' ' ' ILE . 37.0 mt -108.45 120.79 43.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.868 -0.605 . . . . 75.25 110.305 173.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.498 HG23 ' HB3' ' A' ' 40' ' ' GLU . 79.6 t -102.11 126.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.726 -0.67 . . . . 73.43 109.573 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.59 HG23 HD22 ' A' ' 61' ' ' LEU . 59.2 t -96.55 105.98 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 109.193 -0.669 . . . . 64.33 109.193 175.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.573 ' O ' HG21 ' A' ' 60' ' ' VAL . 35.6 m-85 -82.95 105.15 13.71 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.26 -0.644 . . . . 74.21 109.26 174.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.57 -168.15 12.65 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.568 -0.825 . . . . 74.35 111.488 -177.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.41 ' CG ' HG13 ' A' ' 58' ' ' VAL . 3.1 ptm180 -169.76 -159.03 0.2 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.882 -0.784 . . . . 74.42 108.882 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.98 109.04 0.28 Allowed 'General case' 0 C--N 1.318 -0.793 0 O-C-N 124.185 0.928 . . . . 73.21 109.271 171.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -155.31 -170.69 21.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.299 -0.953 . . . . 74.12 112.8 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.02 -155.09 0.59 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.562 0.22 . . . . 73.42 110.424 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.523 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.9 p-80 -52.92 -33.23 49.69 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.988 1.107 . . . . 74.44 113.988 -170.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 20' ' ' LEU . 16.8 mt -56.62 -34.75 67.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.602 0.637 . . . . 72.42 112.025 -176.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.45 ' O ' HG13 ' A' ' 25' ' ' ILE . 37.0 t -63.62 -43.9 95.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.425 -178.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -85.24 -21.29 29.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.52 -0.309 . . . . 73.51 111.29 -177.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.7 mt-10 -66.19 -44.74 83.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.864 0.364 . . . . 72.14 110.121 175.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.542 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.9 mtp -62.77 -40.58 97.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.001 -0.545 . . . . 75.43 110.28 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.537 HG23 HD23 ' A' ' 39' ' ' LEU . 83.6 mt -58.35 -49.85 80.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 72.23 110.562 176.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.48 94.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.362 -0.381 . . . . 63.23 111.194 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -61.3 -43.38 98.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.032 -0.531 . . . . 73.52 110.579 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.621 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 83.1 mt -66.04 -30.8 71.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 75.01 111.2 -179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -63.16 -38.67 92.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.95 0.405 . . . . 74.34 110.411 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.9 t -73.4 -40.54 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 73.34 110.617 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 31' ' ' LEU . 6.8 mt -64.81 -31.79 73.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 74.1 111.142 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -58.23 -24.85 60.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.719 0.295 . . . . 72.0 111.701 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -70.22 -28.97 65.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 74.54 110.537 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -93.71 -44.8 7.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 72.43 110.462 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.514 ' HB3' HD13 ' A' ' 84' ' ' LEU . 50.4 m -143.17 117.86 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.673 -0.694 . . . . 71.04 110.142 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.9 t-105 -78.13 128.92 34.53 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.11 0.481 . . . . 62.11 110.834 -178.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.621 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 2.6 p90 -141.72 20.18 2.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 70.21 110.82 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 59.28 -178.2 0.09 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.147 0.499 . . . . 72.51 110.849 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.537 HD23 HG23 ' A' ' 25' ' ' ILE . 4.5 tp -151.6 109.9 3.76 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.686 -0.405 . . . . 71.24 110.718 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.498 ' HB3' HG23 ' A' ' 11' ' ' VAL . 24.1 tt0 -124.15 117.65 25.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.842 -0.617 . . . . 75.11 109.426 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.57 124.07 68.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.134 -0.484 . . . . 75.15 109.866 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.0 mt -128.9 117.75 45.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.419 -0.355 . . . . 71.53 111.176 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -67.69 114.47 6.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.998 -0.546 . . . . 65.02 111.047 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.6 pt -83.38 -8.85 11.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.452 -0.34 . . . . 75.25 110.62 177.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -74.97 -17.13 60.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 74.14 110.581 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.31 -8.58 59.87 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.942 -0.646 . . . . 62.51 111.954 177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -125.71 101.08 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.966 -0.383 . . . . 70.3 109.966 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -54.43 -33.87 60.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.898 -0.592 . . . . 74.23 112.017 -174.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -66.57 -37.53 85.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 75.11 110.263 -177.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.515 HD21 HD13 ' A' ' 53' ' ' LEU . 74.8 mt -74.9 -24.41 58.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.373 -0.376 . . . . 61.21 110.284 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.8 m -64.99 -33.68 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.407 0.622 . . . . 63.15 109.62 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 mmt85 -77.37 -32.51 55.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.864 -0.607 . . . . 72.51 110.207 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.515 HD13 HD21 ' A' ' 50' ' ' LEU . 82.7 mt -79.15 -24.38 43.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.531 -0.759 . . . . 72.13 111.627 -178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -136.44 -75.51 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.645 0.239 . . . . 73.51 111.645 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.3 t30 46.33 -86.71 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.887 0.875 . . . . 73.52 112.882 -171.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -91.29 49.68 1.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.639 0.733 . . . . 73.25 110.29 -173.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.56 ' O ' HG22 ' A' ' 60' ' ' VAL . 5.7 ttm-85 -156.44 32.05 0.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.703 -1.221 . . . . 73.2 107.703 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.742 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -141.93 0.0 OUTLIER Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.272 0.841 . . . . 72.21 113.272 -166.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.742 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 41.0 Cg_exo -2.53 73.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 122.305 2.003 . . . . 72.14 112.956 -136.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.573 HG21 ' O ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -93.42 116.13 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 114.766 -1.107 . . . . 65.34 111.044 -169.213 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.59 HD22 HG23 ' A' ' 12' ' ' VAL . 32.9 mt -82.65 103.02 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.092 0.472 . . . . 75.4 110.35 173.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.495 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 82.1 t80 -95.19 126.05 40.25 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.171 -0.922 . . . . 72.45 110.013 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.98 108.26 15.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.146 -0.479 . . . . 73.35 110.739 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.433 ' CG2' HG22 ' A' ' 11' ' ' VAL . 51.0 t -77.93 147.19 7.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.11 -0.495 . . . . 72.23 109.731 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 67.45 26.35 8.32 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.076 -0.713 . . . . 74.14 109.076 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.404 ' HG3' ' HG3' ' A' ' 68' ' ' LYS . 7.7 tp10 -149.27 -45.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.051 -0.977 . . . . 71.23 109.433 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.495 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 t70 73.28 37.63 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.972 -1.013 . . . . 75.54 111.591 172.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -149.47 167.04 27.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.137 -0.483 . . . . 74.43 110.045 176.277 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -94.24 157.97 15.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.025 0.44 . . . . 64.14 111.633 -172.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.459 ' CD1' HD12 ' A' ' 80' ' ' ILE . 54.2 mt -112.7 -62.81 1.53 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 73.45 110.033 173.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.3 t -153.8 153.6 32.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 70.13 110.098 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.471 ' CD2' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -128.43 149.35 50.6 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.962 -0.385 . . . . 74.42 109.962 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 74.85 -33.64 0.25 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.81 0.844 . . . . 75.35 113.037 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -141.48 -177.91 5.38 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.016 -0.735 . . . . 75.41 109.016 -174.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 tp -121.1 111.93 18.05 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.779 -0.368 . . . . 74.33 111.195 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -90.69 98.3 11.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.185 -0.672 . . . . 65.45 109.185 175.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.0 m -61.55 -32.09 72.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.09 -0.505 . . . . 74.42 111.635 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.4 -48.33 67.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.86 0.362 . . . . 63.43 110.774 -176.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -66.86 -48.82 78.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.235 -0.439 . . . . 70.14 111.993 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.478 HD11 HD21 ' A' ' 84' ' ' LEU . 8.6 tp -69.69 -30.72 45.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.432 -0.507 . . . . 71.22 110.189 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -30.48 77.69 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.805 -0.712 . . . . 73.32 111.61 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.7 -37.82 55.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.927 0.394 . . . . 74.32 110.697 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -78.69 -54.86 5.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.021 -0.536 . . . . 72.42 111.515 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.514 HD13 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -76.3 -38.4 56.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.126 -0.488 . . . . 73.22 110.851 -175.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 115.557 -0.747 . . . . 74.21 111.243 -176.694 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 . . . . . 0 N--CA 1.446 -0.67 0 N-CA-C 109.504 -0.554 . . . . 73.41 109.504 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 132.12 24.2 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.52 2.147 . . . . 71.34 113.025 -172.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.976 ' NH1' ' O ' ' A' ' 85' ' ' SER . 8.7 ptp180 -88.31 130.34 35.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.589 -0.893 . . . . 75.23 108.589 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.538 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 84.5 tttt -96.09 155.98 16.53 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.134 0.42 . . . . 71.34 112.134 -166.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.557 HD13 HD11 ' A' ' 80' ' ' ILE . 89.7 mt -125.85 148.3 49.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.908 -0.587 . . . . 71.4 110.215 173.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 HG21 ' A' ' 64' ' ' VAL . 55.1 t -127.03 135.51 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 116.239 -0.437 . . . . 71.3 109.958 175.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.742 HG22 HD22 ' A' ' 61' ' ' LEU . 86.8 t -108.85 119.62 58.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.344 -0.389 . . . . 73.13 110.155 176.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -95.9 115.84 28.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.843 -0.429 . . . . 63.51 109.843 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.446 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -139.07 -170.48 11.86 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.379 -0.915 . . . . 65.02 112.104 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -154.48 -177.35 6.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.827 -0.434 . . . . 74.12 109.827 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -78.32 155.6 30.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.146 -0.479 . . . . 72.52 110.825 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.33 31.87 45.03 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.937 -0.649 . . . . 73.43 112.138 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.1 m -143.09 94.08 2.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.803 0.335 . . . . 73.43 110.918 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -70.93 -28.75 64.73 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.24 0.543 . . . . 74.22 110.031 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.46 -34.45 64.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.09 -0.959 . . . . 71.3 110.279 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.9 t -68.13 -37.19 80.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 75.14 110.197 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.406 ' HA ' HD13 ' A' ' 25' ' ' ILE . 40.6 mt-10 -68.92 -33.14 73.26 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.217 0.532 . . . . 73.43 110.094 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.08 -36.7 84.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.657 -0.701 . . . . 73.13 110.409 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.481 ' HE1' ' O ' ' A' ' 74' ' ' PHE . 85.2 mtp -63.99 -43.97 94.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.026 -0.533 . . . . 65.22 109.928 174.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.406 HD13 ' HA ' ' A' ' 22' ' ' GLU . 81.0 mt -55.05 -49.57 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.944 -0.571 . . . . 74.42 110.99 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.15 93.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.933 0.397 . . . . 72.01 110.919 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -62.98 -41.36 99.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.798 -0.637 . . . . 64.14 110.688 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.53 HD23 HD13 ' A' ' 39' ' ' LEU . 8.3 mp -66.45 -33.25 75.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.774 -0.648 . . . . 65.53 111.396 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 29' ' ' ARG . 8.9 mmm180 -62.36 -42.19 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.893 0.378 . . . . 74.42 110.372 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.8 t -66.38 -44.37 90.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 71.12 110.71 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 mt -63.72 -33.61 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.53 -0.305 . . . . 75.14 111.505 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -58.4 -22.41 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.872 0.367 . . . . 74.33 111.898 178.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -81.91 -11.45 58.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.165 0.507 . . . . 62.4 110.769 -178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -110.56 -44.23 3.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.622 -0.717 . . . . 73.13 109.961 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.437 ' HB3' HD12 ' A' ' 84' ' ' LEU . 73.0 m -137.92 115.2 11.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.998 -1.001 . . . . 63.25 109.535 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -80.86 125.16 29.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.065 0.46 . . . . 71.02 110.806 -178.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.852 ' HB3' HD13 ' A' ' 84' ' ' LEU . 5.6 p90 -134.37 17.74 3.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.582 -0.736 . . . . 73.25 110.869 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 59.98 -179.41 0.09 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.33 0.586 . . . . 75.52 110.304 -175.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.53 HD13 HD23 ' A' ' 28' ' ' LEU . 5.2 tp -152.54 112.55 4.0 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.538 -0.465 . . . . 75.52 111.291 172.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' HG22 ' A' ' 11' ' ' VAL . 22.7 tt0 -120.01 117.8 28.98 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.412 -0.588 . . . . 74.02 109.412 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.5 t -105.61 108.23 24.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.945 -0.571 . . . . 75.31 109.694 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.4 mt -108.5 113.02 42.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.852 -0.613 . . . . 73.04 110.526 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.7 m120 -81.1 124.77 29.49 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.644 . . . . 74.2 110.17 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.64 HG22 ' HB3' ' A' ' 50' ' ' LEU . 43.0 pt -69.97 -30.12 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.334 -0.394 . . . . 74.33 110.106 177.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.7 94.29 0.09 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.208 0.527 . . . . 63.25 109.874 170.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.02 -27.94 2.27 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.55 -1.02 . . . . 73.31 110.55 -174.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -120.65 109.29 15.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.938 -0.393 . . . . 72.43 109.938 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -58.5 -42.75 88.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.048 -0.524 . . . . 75.35 110.712 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -58.48 -41.26 84.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.411 . . . . 75.25 111.25 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.64 ' HB3' HG22 ' A' ' 44' ' ' ILE . 80.9 mt -76.31 -30.33 57.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.585 -0.279 . . . . 73.13 110.901 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.4 m -61.96 -45.35 94.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.085 0.469 . . . . 74.2 110.081 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -63.99 -30.91 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.063 -0.517 . . . . 75.24 110.926 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.07 -44.28 12.41 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.084 0.772 . . . . 75.43 113.084 -174.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -117.03 -2.92 11.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.817 1.043 . . . . 74.51 113.817 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -77.76 82.85 4.13 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 119.485 -0.886 . . . . 73.24 111.219 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.0 t70 171.63 -48.29 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 114.557 -1.201 . . . . 72.1 108.484 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 60' ' ' VAL . 18.0 ptt180 -109.1 54.11 0.67 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.419 -1.264 . . . . 72.45 109.613 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.787 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -144.97 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 112.228 0.455 . . . . 74.54 112.228 -171.402 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.787 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 67.8 Cg_exo -4.89 77.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.642 0 C-N-CA 122.599 2.199 . . . . 72.41 113.72 -138.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -92.12 128.05 43.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.087 -0.96 . . . . 74.22 110.469 -171.641 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.742 HD22 HG22 ' A' ' 12' ' ' VAL . 2.1 tm? -102.03 108.11 19.44 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.381 -0.599 . . . . 75.21 109.381 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -99.86 141.91 32.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.347 -0.842 . . . . 75.21 111.258 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.61 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -92.38 111.5 23.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.594 . . . . 73.22 111.0 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.596 HG21 HG21 ' A' ' 11' ' ' VAL . 21.6 t -99.42 88.37 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.587 0.708 . . . . 72.13 110.819 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 175.29 -44.34 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.045 -1.835 . . . . 73.31 106.045 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -125.53 104.83 8.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.71 -1.586 . . . . 61.41 107.474 163.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -52.12 90.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 124.264 0.977 . . . . 64.44 111.741 -175.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -160.85 156.62 25.34 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.842 -1.072 . . . . 74.24 110.105 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -89.84 141.04 29.01 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.637 -0.505 . . . . 74.15 109.637 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.3 mt -94.21 -55.67 3.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.45 110.166 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.2 t -158.63 175.13 14.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.03 -0.532 . . . . 63.0 109.852 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -144.2 136.77 26.84 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.802 -0.444 . . . . 62.23 109.802 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.422 ' HH ' HG21 ' A' ' 58' ' ' VAL . 96.0 m-85 73.99 139.56 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.518 1.136 . . . . 74.21 111.268 -174.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.481 ' O ' ' HE1' ' A' ' 24' ' ' MET . 98.1 m-85 61.15 -141.84 0.5 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.063 -0.971 . . . . 73.51 110.132 175.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' A' ' 75' ' ' LEU . 14.0 tp -153.83 113.93 3.91 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.463 -0.495 . . . . 74.23 110.419 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.407 ' OD2' ' HB ' ' A' ' 79' ' ' VAL . 4.4 p-10 -58.66 -38.99 79.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.653 -0.703 . . . . 74.2 109.965 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.68 -49.8 0.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.364 -0.834 . . . . 65.33 112.004 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -79.22 -40.06 31.65 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.618 0.229 . . . . 64.42 111.618 -176.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.407 ' HB ' ' OD2' ' A' ' 76' ' ' ASP . 54.1 t -69.53 -47.65 70.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.62 0.247 . . . . 74.25 110.535 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.557 HD11 HD13 ' A' ' 10' ' ' LEU . 10.2 tp -65.57 -31.07 52.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.845 -0.342 . . . . 75.42 110.095 174.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.66 -29.14 74.48 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 120.768 -0.73 . . . . 64.33 111.61 176.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.73 -39.58 26.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.265 0.555 . . . . 72.34 110.278 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.61 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 82.3 t80 -71.88 -32.07 67.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.576 -0.738 . . . . 75.42 111.493 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.852 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -92.22 8.12 39.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.118 -0.492 . . . . 71.53 111.323 -178.319 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.976 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 8.3 t . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.176 -0.675 . . . . 65.21 109.176 176.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 . . . . . 0 N--CA 1.448 -0.56 0 N-CA-C 108.659 -0.867 . . . . 72.12 108.659 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.46 130.06 14.53 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.855 1.703 . . . . 74.43 111.892 -176.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -96.27 -172.45 2.54 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.931 -0.766 . . . . 75.41 108.931 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 26.3 mtpt -139.77 120.09 13.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.235 0.54 . . . . 65.51 111.138 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.506 HD13 HD11 ' A' ' 80' ' ' ILE . 29.7 mt -107.34 123.64 48.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.349 -0.841 . . . . 72.22 110.59 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.56 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 47.8 t -102.28 127.17 56.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.874 -0.603 . . . . 73.13 109.51 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.549 HG22 ' CD2' ' A' ' 61' ' ' LEU . 40.7 t -104.02 108.8 25.47 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.091 -0.504 . . . . 65.32 109.913 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -79.58 112.57 16.97 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.986 -0.746 . . . . 73.43 108.986 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.74 179.67 16.58 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.639 -0.791 . . . . 44.31 112.218 -177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.451 ' HB3' ' HG ' ' A' ' 18' ' ' CYS . 0.3 OUTLIER -151.56 118.57 5.86 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.34 -0.615 . . . . 75.02 109.34 -176.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.69 107.16 0.56 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.933 -0.576 . . . . 73.23 110.883 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.11 -20.01 4.06 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.584 -0.735 . . . . 64.14 111.366 -175.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.451 ' HG ' ' HB3' ' A' ' 15' ' ' ARG . 60.5 m -87.56 118.94 27.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.869 0.366 . . . . 71.34 110.264 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.475 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 33.4 t60 -71.41 -33.56 69.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.51 . . . . 72.34 111.328 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.7 mt -65.25 -31.01 71.94 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.778 -0.369 . . . . 74.21 110.842 176.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.405 ' O ' HG13 ' A' ' 25' ' ' ILE . 42.9 t -54.97 -47.31 74.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.079 -0.51 . . . . 73.54 110.989 -178.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.16 -32.22 68.65 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.364 -0.38 . . . . 73.25 110.945 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.0 mt-10 -71.61 -34.9 70.24 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.074 -0.512 . . . . 72.32 110.522 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.754 ' HG3' ' HB3' ' A' ' 59' ' ' PRO . 87.1 mmm -63.83 -43.04 97.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.902 -0.59 . . . . 74.23 110.123 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 21' ' ' CYS . 77.1 mt -54.4 -50.58 56.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 75.03 110.78 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.84 -39.74 86.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.343 -0.39 . . . . 65.34 110.973 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -61.64 -44.0 97.8 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.949 -0.569 . . . . 75.23 110.704 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.417 HD21 ' O ' ' A' ' 24' ' ' MET . 4.2 mm? -66.11 -38.46 88.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.96 -0.564 . . . . 75.14 111.299 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 13.1 mmm180 -58.2 -41.83 84.86 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.676 0.274 . . . . 72.51 111.574 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.89 -40.49 81.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.856 0.36 . . . . 74.41 111.056 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -33.55 70.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.02 0.438 . . . . 74.41 109.92 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.59 -30.15 69.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.53 -0.759 . . . . 74.54 110.742 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 29' ' ' ARG . 52.7 mtmt -69.28 -33.62 73.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 75.23 110.749 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -83.15 -46.06 13.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.619 -0.718 . . . . 73.5 110.281 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.406 ' HB3' HD11 ' A' ' 84' ' ' LEU . 21.9 m -135.22 118.24 16.38 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.661 -0.7 . . . . 74.3 109.511 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -76.99 117.81 18.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.476 0.655 . . . . 70.41 111.447 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.472 ' HB3' HD12 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -129.34 22.98 5.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.303 -0.862 . . . . 74.43 110.43 177.427 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.425 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 19.9 mm-40 57.4 -179.93 0.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.501 -175.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 tp -152.55 117.03 4.99 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.877 -0.729 . . . . 73.44 110.778 173.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.557 ' HB3' HG21 ' A' ' 11' ' ' VAL . 14.9 tt0 -124.41 117.39 24.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.872 -0.788 . . . . 60.14 108.872 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 56.3 t -109.04 111.43 36.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.305 -0.407 . . . . 74.31 109.905 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.6 mt -117.86 109.93 29.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.062 -0.517 . . . . 73.21 110.741 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.69 124.82 27.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.978 177.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.7 pt -86.8 -14.55 10.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.56 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.51 -34.67 67.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.841 -0.618 . . . . 75.41 111.82 -174.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.9 27.41 10.09 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.704 -0.76 . . . . 73.25 113.02 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -152.76 115.66 4.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.645 -0.327 . . . . 74.11 110.512 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.69 -34.92 67.9 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.797 0.295 . . . . 73.05 111.797 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -69.34 -53.86 17.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.801 -0.444 . . . . 64.32 109.801 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 mt -65.79 -39.45 90.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.757 -0.656 . . . . 74.5 111.381 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.531 ' HA ' HD12 ' A' ' 44' ' ' ILE . 95.2 m -54.24 -57.72 10.11 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 120.612 0.244 . . . . 71.35 110.753 178.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 -67.54 -31.02 70.83 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 121.069 -0.252 . . . . 75.24 111.264 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -52.39 41.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.54 -0.3 . . . . 74.41 111.52 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -111.47 19.74 17.9 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 112.352 0.501 . . . . 75.2 112.352 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.83 -37.74 80.08 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.224 0.466 . . . . 62.24 110.568 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -103.07 14.11 32.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.7 0.762 . . . . 70.41 109.741 176.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.515 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 14.2 ttm180 -138.44 29.14 2.44 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.897 -0.592 . . . . 73.33 109.648 -176.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.837 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -84.5 -146.42 0.0 OUTLIER Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 118.525 -0.75 . . . . 72.25 109.729 176.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.837 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 35.1 Cg_exo -2.43 70.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.991 0 C-N-CA 122.351 2.034 . . . . 63.21 112.694 -139.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.58 HG22 ' HB3' ' A' ' 72' ' ' HIS . 4.0 p -116.91 139.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-N 114.553 -1.203 . . . . 74.5 110.396 -165.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.549 ' CD2' HG22 ' A' ' 12' ' ' VAL . 58.6 mt -103.13 110.6 22.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.985 0.421 . . . . 75.05 110.923 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.56 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.1 t80 -92.18 120.48 32.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.623 -0.717 . . . . 72.43 109.909 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.97 100.65 9.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.63 . . . . 71.54 110.981 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 97.7 t -79.02 98.83 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.336 -0.393 . . . . 73.23 110.291 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 168.46 -39.53 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.273 -0.876 . . . . 75.14 108.691 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -125.34 1.87 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.521 -0.763 . . . . 71.33 110.672 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.89 81.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.662 -0.699 . . . . 75.42 111.952 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -173.03 149.6 1.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 73.53 110.043 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -88.07 144.93 26.23 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.851 -0.426 . . . . 74.33 109.851 175.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.4 mt -88.36 -51.33 5.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.014 0.435 . . . . 74.31 110.671 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.7 t -150.79 158.84 44.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 70.24 109.898 -177.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.58 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.2 p80 -136.17 129.43 31.69 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.661 -0.496 . . . . 74.51 109.661 177.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 65.47 121.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 124.18 0.925 . . . . 73.32 110.472 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 69.5 171.75 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.193 -0.912 . . . . 71.34 110.767 -175.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.1 tp -123.24 118.3 27.28 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.751 -0.379 . . . . 72.4 111.83 -169.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -92.64 106.24 18.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.915 -0.584 . . . . 61.21 110.026 173.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.1 m -68.52 -39.42 81.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.012 -0.54 . . . . 74.41 111.534 -176.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.46 -41.11 85.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.945 0.402 . . . . 63.55 111.046 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.4 t -66.52 -41.47 88.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 70.34 111.536 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.506 HD11 HD13 ' A' ' 10' ' ' LEU . 8.4 tp -72.55 -31.67 38.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.188 -0.605 . . . . 74.42 110.022 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.58 78.06 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.748 -0.739 . . . . 64.55 111.554 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.14 -29.83 66.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.757 0.313 . . . . 73.33 111.042 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -87.12 -42.26 13.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 74.11 111.556 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.472 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -69.02 -21.18 64.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.065 -0.516 . . . . 74.34 111.95 -174.474 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.326 -0.452 0 N-CA-C 109.628 -0.508 . . . . 63.23 109.628 176.501 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 . . . . . 0 N--CA 1.442 -0.843 0 N-CA-C 109.833 -0.432 . . . . 63.2 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -75.51 177.94 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.341 2.027 . . . . 64.34 111.729 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -91.93 -179.1 5.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.322 -0.622 . . . . 75.32 109.322 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.746 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.3 tmtp? -142.64 115.17 8.53 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.041 0.448 . . . . 70.03 109.918 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.484 HD12 HD11 ' A' ' 80' ' ' ILE . 79.7 mt -105.66 133.37 50.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.941 -0.572 . . . . 73.2 111.131 178.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.581 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 68.2 t -107.34 127.3 63.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.602 -0.726 . . . . 74.32 109.61 172.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.639 HG22 HD23 ' A' ' 61' ' ' LEU . 92.4 t -96.64 112.13 28.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 120.953 0.406 . . . . 71.44 110.206 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.449 ' CB ' HG23 ' A' ' 60' ' ' VAL . 61.1 m-85 -81.91 111.86 18.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.161 -0.472 . . . . 75.54 109.879 175.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -120.92 -161.72 11.49 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 110.361 -1.096 . . . . 75.42 110.361 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -164.48 -53.52 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.692 0.746 . . . . 73.35 112.28 176.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -137.08 -175.19 3.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.606 -0.27 . . . . 71.42 111.068 -169.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -79.0 62.61 3.96 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 116.073 -0.512 . . . . 74.5 113.322 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 m -81.84 134.55 35.43 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.212 -0.662 . . . . 72.3 109.212 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.496 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.0 t60 -68.48 -38.66 81.23 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.504 -0.478 . . . . 73.04 109.836 -176.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 20' ' ' LEU . 23.3 mt -57.37 -31.62 65.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.439 -0.346 . . . . 62.2 111.499 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.443 ' O ' HG13 ' A' ' 25' ' ' ILE . 41.9 t -57.62 -49.5 76.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.452 -0.34 . . . . 75.12 110.426 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.63 -29.2 65.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.783 0.325 . . . . 71.12 110.436 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 38.2 mt-10 -70.1 -39.73 75.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.985 0.421 . . . . 73.34 110.151 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 89.9 mmm -64.62 -45.49 86.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.048 -0.524 . . . . 72.53 110.004 174.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 21' ' ' CYS . 81.2 mt -55.41 -49.64 71.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.261 -0.427 . . . . 73.51 110.285 177.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -60.03 -42.81 95.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.706 0.289 . . . . 75.32 110.9 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.2 m -55.79 -49.08 74.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.757 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.449 HD22 HD11 ' A' ' 61' ' ' LEU . 4.2 mm? -67.25 -38.86 85.86 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.155 -0.475 . . . . 73.11 111.155 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -61.07 -38.75 87.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 71.42 110.987 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 26' ' ' ALA . 93.9 t -68.53 -44.28 83.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.258 -0.428 . . . . 63.52 111.101 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.48 -32.22 73.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.153 0.502 . . . . 70.22 109.732 178.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 35' ' ' SER . 35.5 tt0 -64.13 -21.64 66.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.598 -0.728 . . . . 71.32 110.404 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -78.45 -11.84 59.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.585 -0.734 . . . . 71.31 110.943 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.18 -48.48 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.168 0.508 . . . . 73.13 109.716 173.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.443 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 21.7 m -133.81 127.99 33.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.405 -0.816 . . . . 73.25 110.209 -177.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -82.22 131.3 35.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.217 0.532 . . . . 74.13 111.354 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.507 ' HB3' HD23 ' A' ' 84' ' ' LEU . 7.5 p90 -140.21 22.01 2.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.419 -0.81 . . . . 75.25 110.697 177.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 58.2 -176.08 0.08 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.135 -0.484 . . . . 64.21 110.402 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.28 137.03 19.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.759 -0.46 . . . . 71.42 109.759 175.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.54 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . 4.2 tp10 -136.71 143.42 43.34 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.139 -0.689 . . . . 73.33 109.139 174.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -127.9 109.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.999 -0.371 . . . . 75.51 109.999 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.45 HD11 HG13 ' A' ' 11' ' ' VAL . 75.9 mt -123.99 109.85 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.309 -0.405 . . . . 63.35 110.881 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -81.53 111.42 17.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.219 -0.446 . . . . 74.11 110.129 176.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.4 pt -76.97 -2.01 4.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 73.32 111.153 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -61.96 -32.66 73.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.099 -0.501 . . . . 45.22 110.766 -178.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -95.53 0.58 63.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.918 -0.658 . . . . 72.23 112.116 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.68 97.82 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.716 -0.476 . . . . 74.54 109.716 -179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -58.79 -43.04 90.38 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.735 -0.666 . . . . 75.44 111.276 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -76.08 -30.51 58.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.677 0.275 . . . . 60.45 110.851 -172.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.17 -26.69 53.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.818 0.342 . . . . 70.03 110.71 176.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.5 m -59.89 -37.68 80.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.635 176.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -56.41 -32.56 64.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.165 0.507 . . . . 73.15 110.706 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.15 -57.5 2.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.774 -0.648 . . . . 74.22 111.572 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -104.51 13.66 31.37 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.116 0.784 . . . . 74.51 113.116 -166.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -52.59 -58.22 7.49 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.341 0.519 . . . . 55.53 111.852 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -90.7 -3.18 57.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.023 0.439 . . . . 74.42 111.3 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.25 74.52 1.24 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.969 -0.752 . . . . 74.13 108.969 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.838 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -100.52 -141.17 0.0 OUTLIER Pre-proline 0 N--CA 1.439 -1.01 0 CA-C-O 118.37 -0.824 . . . . 75.42 109.835 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.838 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 77.2 Cg_exo -9.03 71.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.806 0 C-N-CA 122.778 2.318 . . . . 72.34 114.351 -140.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.449 HG23 ' CB ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -103.89 136.26 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.423 -0.808 . . . . 75.34 111.583 -173.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.639 HD23 HG22 ' A' ' 12' ' ' VAL . 96.1 mt -93.32 109.22 20.77 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.488 -0.778 . . . . 73.14 110.216 177.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.581 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.0 t80 -92.08 125.5 36.79 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.362 -0.835 . . . . 74.45 109.937 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.501 ' HB2' ' HG3' ' A' ' 68' ' ' LYS . . . -82.64 104.94 13.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 72.24 110.566 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.746 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 85.5 t -70.9 154.29 8.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.567 -0.531 . . . . 74.01 109.567 177.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 78.98 -38.03 0.2 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.714 0.806 . . . . 75.11 110.145 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -87.13 -33.61 19.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.859 -0.61 . . . . 72.43 111.031 175.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.548 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 61.7 66.34 0.85 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.561 0.696 . . . . 65.35 109.905 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 63' ' ' ALA . 3.2 ptpp? -160.23 153.51 21.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.294 -0.866 . . . . 75.45 109.992 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 mp0 -87.66 144.19 26.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.34 -0.615 . . . . 71.2 109.34 174.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.2 mt -109.99 -56.51 2.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.023 0.44 . . . . 74.14 111.291 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 46.6 t -140.76 157.49 45.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.897 -0.592 . . . . 72.52 110.472 -169.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 18.3 p-80 -127.63 -171.96 2.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.344 -0.613 . . . . 74.34 109.344 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -48.88 144.27 4.74 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.606 0.241 . . . . 71.02 111.548 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 71.1 90.15 0.1 Allowed 'General case' 0 C--O 1.236 0.355 0 O-C-N 124.101 0.875 . . . . 74.42 108.827 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.72 126.2 25.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.659 -1.155 . . . . 74.14 111.522 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -75.15 -35.96 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.763 -0.653 . . . . 75.13 110.238 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.37 -48.19 0.68 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.099 -0.955 . . . . 74.23 112.278 178.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.45 -50.6 58.49 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.819 0.303 . . . . 72.11 111.819 -175.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.6 -51.24 75.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 111.782 0.29 . . . . 63.01 111.782 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.791 HD11 HD21 ' A' ' 84' ' ' LEU . 7.1 tp -68.47 -29.57 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 119.834 -0.746 . . . . 74.15 110.298 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.04 -41.35 97.26 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.684 -0.77 . . . . 73.03 111.582 176.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.37 -26.38 68.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.28 0.562 . . . . 62.22 110.633 176.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -88.0 -50.37 6.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.796 -0.638 . . . . 73.32 111.52 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.791 HD21 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -76.52 -39.18 53.74 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.335 0.495 . . . . 74.1 112.335 -172.123 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.7 p . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.778 -0.369 . . . . 74.52 111.345 -173.919 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 . . . . . 0 N--CA 1.449 -0.513 0 N-CA-C 110.665 -0.124 . . . . 74.15 110.665 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.4 173.62 10.39 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.754 2.303 . . . . 74.53 112.896 -175.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HG3' ' HA ' ' A' ' 84' ' ' LEU . 0.5 OUTLIER -108.26 -170.23 1.64 Allowed 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.042 -0.725 . . . . 73.02 109.042 178.093 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 83.6 tttt -146.58 128.68 15.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.081 0.467 . . . . 74.32 110.57 171.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.528 HD12 HD11 ' A' ' 61' ' ' LEU . 80.6 mt -114.96 129.82 56.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 72.25 110.212 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -107.63 126.36 63.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.061 -0.518 . . . . 75.42 109.704 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.569 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 55.8 t -106.09 108.66 25.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.284 0.564 . . . . 63.41 110.058 176.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.68 110.62 17.2 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 73.15 109.069 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.539 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -113.95 171.06 13.58 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.448 -0.882 . . . . 60.11 113.019 -173.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.5 ttt180 -159.32 21.7 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.386 -0.968 . . . . 74.22 108.386 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 62.07 -97.64 0.07 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.248 -1.342 . . . . 70.34 110.191 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.47 -89.05 1.31 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.898 -0.668 . . . . 72.43 113.103 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.3 t -143.07 -167.69 2.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.77 0.319 . . . . 74.12 110.944 -173.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -69.15 -30.52 68.78 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 113.047 0.758 . . . . 73.14 113.047 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 73' ' ' TYR . 32.4 mt -53.47 -31.29 45.08 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 120.873 -0.331 . . . . 74.32 111.605 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.473 ' O ' HG13 ' A' ' 25' ' ' ILE . 27.1 t -60.14 -48.45 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.492 -0.322 . . . . 72.22 110.912 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.95 -32.86 63.67 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.754 0.311 . . . . 73.41 110.762 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.09 -41.14 96.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.201 0.524 . . . . 75.34 110.06 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.605 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 89.4 mmm -65.27 -46.34 80.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.718 -0.674 . . . . 74.21 110.803 176.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 21' ' ' CYS . 83.8 mt -56.55 -48.2 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.335 -0.393 . . . . 64.4 111.497 -178.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.17 92.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.068 0.461 . . . . 62.14 110.936 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.6 m -64.67 -39.11 93.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.866 -0.606 . . . . 61.13 111.272 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 24' ' ' MET . 83.3 mt -63.41 -38.72 92.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 75.2 110.95 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -62.87 -42.72 99.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 73.33 110.913 -177.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 68.1 t -71.28 -42.48 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.376 -0.375 . . . . 74.45 110.983 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.42 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -66.02 -31.87 73.02 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.048 -0.353 . . . . 71.31 110.048 -179.657 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -28.94 64.86 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.965 0.412 . . . . 75.41 110.907 176.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -79.86 -12.49 59.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 72.23 110.868 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -103.63 -41.73 5.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 73.43 109.748 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.402 ' CB ' HD11 ' A' ' 84' ' ' LEU . 43.5 m -148.52 119.13 7.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.089 -0.959 . . . . 71.13 109.13 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -72.28 129.58 38.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 71.23 111.239 -176.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.621 ' HB3' HD12 ' A' ' 84' ' ' LEU . 7.8 p90 -139.53 21.7 2.53 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.67 -0.695 . . . . 72.11 110.932 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 59.15 -177.62 0.09 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.94 0.4 . . . . 73.02 110.309 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 39' ' ' LEU . 7.0 tp -154.3 109.96 3.18 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.485 -0.486 . . . . 64.32 110.476 168.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -114.75 117.87 31.98 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.425 -0.583 . . . . 73.34 109.425 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.7 t -110.84 110.3 31.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.902 -0.59 . . . . 75.12 110.249 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.1 mt -119.6 111.26 32.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.167 -0.47 . . . . 64.33 110.544 -176.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.2 m120 -81.16 113.95 19.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.25 -0.432 . . . . 61.33 110.175 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 51' ' ' THR . 33.8 pt -79.4 0.01 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.926 -0.579 . . . . 73.53 111.964 -173.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.2 -39.52 90.52 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.088 0.471 . . . . 73.34 111.062 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.03 8.73 68.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.777 -0.725 . . . . 65.1 112.753 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -137.71 97.48 3.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.735 0.268 . . . . 74.52 110.557 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -54.22 -33.94 59.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.282 -0.417 . . . . 63.14 110.456 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.3 m170 -57.19 -48.95 77.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.5 -0.773 . . . . 74.43 110.064 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 53' ' ' LEU . 90.8 mt -77.84 -26.8 49.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.811 -0.632 . . . . 74.22 111.087 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.541 ' HA ' HD12 ' A' ' 44' ' ' ILE . 85.5 m -56.37 -48.97 75.76 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.296 -0.411 . . . . 74.24 111.24 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -66.39 -31.7 72.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.838 0.351 . . . . 75.53 110.836 -176.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 50' ' ' LEU . 71.0 mt -64.32 -48.49 75.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.888 -0.596 . . . . 73.12 111.314 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.08 24.84 10.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.43 -0.35 . . . . 74.35 111.905 -172.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 56' ' ' ASP . 28.1 t-20 -62.36 120.72 11.57 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.023 -0.271 . . . . 73.15 110.43 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 55' ' ' ASN . 20.8 t70 71.66 -3.49 2.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.752 0.786 . . . . 62.4 110.614 -176.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -115.43 32.91 5.76 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.195 -0.669 . . . . 73.14 109.195 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.758 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -82.51 -140.85 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.662 0 CA-C-O 118.636 -0.697 . . . . 75.44 111.071 -176.424 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.758 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 28.1 Cg_exo -3.89 69.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.729 0 C-N-CA 122.536 2.157 . . . . 63.51 113.278 -139.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -92.08 131.41 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-N 114.641 -1.163 . . . . 73.44 110.837 -172.215 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.528 HD11 HD12 ' A' ' 10' ' ' LEU . 2.3 tm? -97.65 101.99 13.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.591 -0.892 . . . . 74.12 108.591 174.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.505 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.2 t80 -95.29 124.55 39.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.866 -1.061 . . . . 73.11 110.435 -175.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 106.17 17.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.052 -0.522 . . . . 63.12 110.58 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.3 t -67.72 152.85 9.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.558 -0.534 . . . . 71.33 109.558 178.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 76.74 -39.01 0.33 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.528 0.731 . . . . 74.01 110.551 -176.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.513 ' HB3' ' CG ' ' A' ' 68' ' ' LYS . 21.2 mm-40 -76.73 -35.98 57.44 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.44 -0.578 . . . . 74.54 109.44 170.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.505 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 0.5 OUTLIER 61.51 41.7 12.24 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.89 -1.05 . . . . 74.13 109.479 179.509 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.513 ' CG ' ' HB3' ' A' ' 66' ' ' GLU . 1.2 ptpp? -142.15 164.5 30.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.036 -0.984 . . . . 73.1 110.471 -178.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -87.47 134.68 33.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.209 -0.451 . . . . 75.34 110.079 174.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.27 -49.99 6.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.255 -0.646 . . . . 71.25 109.255 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.9 t -168.15 165.97 13.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.984 -0.747 . . . . 73.43 108.984 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.606 ' HD2' ' CD2' ' A' ' 73' ' ' TYR . 49.5 p-80 -144.17 143.99 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 121.202 -0.199 . . . . 63.54 110.661 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.606 ' CD2' ' HD2' ' A' ' 72' ' ' HIS . 64.3 m-85 74.15 -34.65 0.28 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 124.129 0.893 . . . . 72.23 111.785 -176.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.411 ' H ' ' C ' ' A' ' 72' ' ' HIS . 58.1 m-85 -126.51 165.48 19.05 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.616 -0.513 . . . . 75.35 109.616 -176.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.7 tp -119.71 103.37 9.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.987 0.422 . . . . 72.41 111.017 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.29 96.63 10.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.812 -0.631 . . . . 71.52 109.567 174.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.484 ' HA ' HG21 ' A' ' 80' ' ' ILE . 8.6 m -61.56 -30.1 70.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.674 -0.693 . . . . 72.33 111.472 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -64.18 -42.53 96.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 74.12 110.558 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 71.0 t -75.52 -44.37 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 74.23 111.359 -177.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.506 HD11 HD11 ' A' ' 10' ' ' LEU . 8.0 tp -66.44 -34.32 69.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.358 -0.537 . . . . 72.35 110.269 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.08 91.49 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.882 -0.675 . . . . 74.04 111.779 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.77 -33.38 75.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 73.01 111.038 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -87.35 -40.19 14.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.971 -0.559 . . . . 75.04 111.88 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -76.8 2.41 14.52 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.699 0.629 . . . . 71.24 112.699 -171.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--N 1.319 -0.729 0 N-CA-C 110.224 -0.288 . . . . 72.32 110.224 176.342 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 . . . . . 0 C--O 1.238 0.484 0 CA-C-O 120.948 0.404 . . . . 74.44 111.126 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.98 144.74 43.51 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.306 2.004 . . . . 73.1 112.312 -177.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.56 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -111.9 138.79 48.04 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.82 -0.807 . . . . 72.5 108.82 175.864 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 77.9 tttt -88.05 149.79 23.77 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.281 0.562 . . . . 54.51 112.501 -167.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.471 HD12 HD13 ' A' ' 80' ' ' ILE . 75.2 mt -115.45 131.78 56.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.274 -0.876 . . . . 75.55 110.717 174.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.568 HG22 ' CG2' ' A' ' 64' ' ' VAL . 52.5 t -104.33 133.81 47.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 75.22 109.42 172.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.496 HG23 HD21 ' A' ' 61' ' ' LEU . 21.8 t -98.86 105.7 17.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 C-N-CA 120.165 -0.614 . . . . 75.54 109.426 172.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.691 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 23.6 m-85 -72.13 154.42 41.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 109.189 -0.671 . . . . 73.12 109.189 174.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.55 ' HA2' HG12 ' A' ' 58' ' ' VAL . . . 156.01 -145.27 11.98 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.248 -0.977 . . . . 64.15 111.963 175.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 8.9 ptm180 -161.03 177.27 10.5 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.447 -0.575 . . . . 73.42 109.447 176.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -77.88 111.48 13.75 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.113 0.482 . . . . 75.23 111.656 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.71 63.43 0.2 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.852 -0.613 . . . . 64.12 112.669 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -148.38 115.34 6.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 71.33 110.814 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.45 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 57.1 t60 -70.91 -39.14 72.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.359 -0.382 . . . . 73.03 111.388 -176.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.432 HD21 ' OE2' ' A' ' 23' ' ' GLU . 15.8 mt -59.72 -31.18 69.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.877 0.37 . . . . 75.03 110.986 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.586 ' O ' HG13 ' A' ' 25' ' ' ILE . 35.3 t -61.04 -45.89 92.93 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.591 -0.522 . . . . 60.03 109.591 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.409 ' O ' ' HB ' ' A' ' 25' ' ' ILE . 30.2 mt-10 -60.73 -47.75 84.9 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.853 -0.612 . . . . 62.15 110.733 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 31.9 mt-10 -63.22 -38.3 90.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.419 -0.809 . . . . 73.1 111.619 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 45.5 mtp -72.13 -27.94 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.667 -0.413 . . . . 74.4 110.852 177.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 21' ' ' CYS . 67.6 mt -59.12 -45.91 92.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.986 -0.375 . . . . 70.45 109.986 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.97 -41.73 96.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.088 -0.505 . . . . 64.31 110.746 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 m -65.18 -42.38 93.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.009 -0.541 . . . . 73.33 110.719 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 24' ' ' MET . 79.0 mt -67.27 -31.95 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 75.45 111.101 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.6 mmm-85 -62.11 -44.02 97.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.07 0.462 . . . . 71.54 110.156 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.9 t -62.97 -41.46 92.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 73.12 110.492 177.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.1 -33.86 75.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.359 -0.382 . . . . 74.44 110.284 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 35' ' ' SER . 39.8 mt-30 -61.23 -20.86 63.3 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.754 0.312 . . . . 64.35 111.484 177.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -78.74 -17.72 55.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.168 0.509 . . . . 71.54 110.687 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -99.09 -45.98 5.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 74.14 109.563 176.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 25.5 m -144.88 122.83 12.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.367 -0.833 . . . . 71.11 109.559 -178.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -78.68 135.33 37.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.642 0.258 . . . . 72.53 110.651 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.513 ' HB3' HD12 ' A' ' 84' ' ' LEU . 8.2 p90 -146.01 14.23 1.32 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.487 -0.324 . . . . 74.11 111.561 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 54.9 -174.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.626 0.726 . . . . 53.52 111.203 -175.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 39' ' ' LEU . 6.0 tp -150.85 109.8 3.89 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.83 -0.623 . . . . 75.4 110.351 174.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.536 ' HB3' HG23 ' A' ' 11' ' ' VAL . 6.2 tp10 -108.7 147.17 32.33 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 75.24 110.225 -178.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -123.65 125.62 71.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.605 -0.517 . . . . 74.12 109.605 176.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.46 HD13 HG12 ' A' ' 11' ' ' VAL . 77.7 mt -135.43 119.87 26.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.919 0.39 . . . . 72.33 110.804 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.6 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 42.6 m-80 -80.66 129.61 34.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 73.3 111.311 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 51' ' ' THR . 28.0 pt -88.56 -15.48 9.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.948 -0.569 . . . . 75.33 110.323 175.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -48.48 -45.67 37.16 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.283 -0.872 . . . . 74.14 112.472 -172.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -87.78 -0.58 83.66 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.654 -0.784 . . . . 64.32 113.276 -176.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -110.42 111.82 23.34 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.165 -0.309 . . . . 72.32 110.165 -177.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.28 -47.29 78.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.995 -0.548 . . . . 72.2 111.721 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -70.75 -37.9 73.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.69 0.281 . . . . 75.22 110.475 -174.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.3 mt -69.22 -33.07 72.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 71.53 110.54 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.458 ' HA ' HD12 ' A' ' 44' ' ' ILE . 94.3 m -57.69 -56.76 17.72 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.188 -0.46 . . . . 61.13 110.475 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.789 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.54 -29.9 68.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.753 0.279 . . . . 75.15 111.753 -178.437 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.6 mt -75.76 -48.13 23.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.466 0.543 . . . . 73.01 112.466 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -122.83 7.87 9.37 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 113.621 0.971 . . . . 74.41 113.621 -167.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -59.86 -50.42 73.86 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 118.746 0.703 . . . . 74.24 111.766 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -77.12 -20.58 55.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.907 -0.588 . . . . 62.54 111.169 -175.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -128.63 75.15 1.61 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.303 -0.628 . . . . 74.12 109.303 175.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.851 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.19 -142.92 0.0 OUTLIER Pre-proline 0 N--CA 1.438 -1.061 0 CA-C-O 117.823 -1.084 . . . . 74.45 109.335 176.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.851 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 94.7 Cg_exo -10.96 101.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.954 0 C-N-CA 122.32 2.013 . . . . 74.31 113.787 -141.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.445 ' HA ' ' CB ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -129.43 142.82 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 123.427 0.455 . . . . 72.35 110.98 -176.317 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 1.03 ' HG ' ' HD2' ' A' ' 72' ' ' HIS . 22.7 mt -88.11 123.3 32.63 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.094 0.473 . . . . 75.03 111.539 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.495 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 89.7 t80 -105.28 129.9 53.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.083 -0.962 . . . . 74.51 110.296 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 83' ' ' TYR . . . -80.43 104.07 10.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.165 -0.47 . . . . 73.43 110.926 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.568 ' CG2' HG22 ' A' ' 11' ' ' VAL . 46.9 t -80.79 81.78 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.964 0.412 . . . . 75.21 110.668 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 172.92 -59.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.124 -0.944 . . . . 64.22 108.963 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.05 -7.9 52.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.554 -0.748 . . . . 74.35 110.35 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.4 t70 60.58 78.79 0.27 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.522 0.677 . . . . 74.44 111.395 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -171.42 148.42 2.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.486 -0.779 . . . . 74.53 110.932 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.2 137.69 38.28 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.748 -0.464 . . . . 53.23 109.748 174.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 mt -98.97 -82.41 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.9 0.381 . . . . 73.42 110.447 178.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.401 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 45.6 t -166.37 148.59 6.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 64.05 109.96 -177.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 1.03 ' HD2' ' HG ' ' A' ' 61' ' ' LEU . 4.9 t-80 -146.28 -170.54 3.52 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.483 -0.562 . . . . 75.51 109.483 176.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 101.39 -75.74 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.306 1.443 . . . . 72.44 111.412 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -125.56 8.03 7.65 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.174 -0.21 . . . . 74.3 111.272 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.7 tp 71.88 122.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.972 0.795 . . . . 74.43 111.913 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.401 ' OD1' ' HB3' ' A' ' 71' ' ' CYS . 6.1 p-10 -85.56 -40.3 16.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.677 -0.692 . . . . 64.33 110.894 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 61.35 21.17 11.75 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.89 -0.596 . . . . 70.3 111.242 -177.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -127.24 -53.0 1.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.355 0.598 . . . . 73.24 110.354 -175.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.3 t -75.76 -42.93 40.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.514 -0.767 . . . . 72.25 109.904 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.603 HD13 HD23 ' A' ' 84' ' ' LEU . 7.7 tp -66.05 -31.62 54.49 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.239 0 N-CA-C 109.604 -0.517 . . . . 61.4 109.604 174.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.6 -30.14 75.9 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.824 -0.703 . . . . 71.22 111.717 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.57 -27.62 51.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.086 0.469 . . . . 73.45 110.505 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.56 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 69.4 t80 -87.35 -45.41 10.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 65.1 111.817 -177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.603 HD23 HD13 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -74.9 -8.51 56.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.142 -0.481 . . . . 71.11 111.783 -172.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.815 -0.439 . . . . 65.24 109.815 175.082 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 109.994 -0.373 . . . . 73.42 109.994 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -86.83 174.4 5.6 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.435 2.09 . . . . 72.13 112.903 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -107.58 -176.87 3.19 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.258 -1.015 . . . . 72.14 108.258 176.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.9 tmtp? -150.33 132.34 15.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.415 -0.587 . . . . 72.11 109.415 175.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.543 HD12 HD13 ' A' ' 61' ' ' LEU . 92.7 mt -127.77 138.96 52.92 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 71.4 110.57 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' A' ' 40' ' ' GLU . 77.0 t -114.88 137.84 47.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 75.52 110.08 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.643 HG21 HD21 ' A' ' 61' ' ' LEU . 86.0 t -110.14 113.48 44.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.997 0.427 . . . . 73.54 110.18 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.486 ' CB ' HG23 ' A' ' 60' ' ' VAL . 95.2 m-85 -87.11 128.33 35.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.929 -0.767 . . . . 73.52 108.929 174.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.518 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -172.82 -163.15 26.12 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.188 -1.006 . . . . 64.33 111.91 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.523 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 13.1 ptm180 -150.69 132.22 14.77 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.369 -0.604 . . . . 73.05 109.369 175.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.49 118.62 7.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.674 -0.694 . . . . 74.41 111.042 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.06 -20.68 1.94 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.38 -0.827 . . . . 64.2 111.601 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.3 p -96.43 128.83 43.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.795 0.331 . . . . 74.24 110.266 177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -69.33 -33.73 73.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.213 0.449 . . . . 74.42 112.213 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.443 HD21 ' OE2' ' A' ' 23' ' ' GLU . 20.4 mt -58.61 -32.02 68.6 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.758 0.313 . . . . 75.32 111.258 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.86 -42.38 93.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 73.12 110.265 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.08 -45.49 91.85 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.111 -0.495 . . . . 74.11 110.386 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.443 ' OE2' HD21 ' A' ' 20' ' ' LEU . 45.6 mt-10 -61.89 -40.08 94.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.443 -0.799 . . . . 74.01 111.144 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.524 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.6 mtp -68.72 -49.19 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.241 -0.436 . . . . 64.52 110.698 177.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -58.77 -47.64 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-N 116.717 -0.22 . . . . 75.04 111.432 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -36.68 74.16 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.094 0.473 . . . . 64.31 111.076 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.6 m -69.72 -41.44 75.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.873 -0.603 . . . . 72.43 110.66 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 24' ' ' MET . 86.1 mt -66.66 -34.32 77.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.301 -0.408 . . . . 74.53 111.018 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -61.55 -41.84 97.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.34 111.236 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.71 -37.56 43.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.866 0.365 . . . . 75.14 110.596 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 1.5 mt -64.48 -31.93 73.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.42 110.887 178.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.52 -34.52 50.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.123 -0.49 . . . . 72.32 111.704 176.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -73.86 -23.97 59.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 75.01 111.357 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -93.65 -42.59 9.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.397 0.618 . . . . 75.31 109.965 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.472 ' HB3' HD22 ' A' ' 84' ' ' LEU . 69.9 m -143.54 104.03 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.924 -1.035 . . . . 73.43 109.198 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.7 t-105 -69.27 129.79 40.8 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.898 0.38 . . . . 74.04 111.702 -174.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.649 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 30.4 p90 -142.12 18.18 2.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.777 -0.647 . . . . 75.32 111.596 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 59.5 -179.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.032 0.444 . . . . 75.1 110.402 -177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.9 tp -153.14 132.19 12.6 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 120.099 -0.641 . . . . 72.33 110.808 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.49 ' HB3' HG23 ' A' ' 11' ' ' VAL . 7.7 tt0 -136.76 118.19 14.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.551 -0.537 . . . . 75.13 109.551 178.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -107.1 115.82 49.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.525 -0.546 . . . . 73.1 109.525 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.8 mt -115.83 119.69 62.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.775 -175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.523 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 12.0 m-80 -78.23 117.37 19.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 74.43 111.39 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.413 HG23 HD12 ' A' ' 50' ' ' LEU . 23.9 pt -81.01 -7.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 73.33 109.352 174.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -37.69 -46.97 0.94 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.25 -1.341 . . . . 64.15 113.329 -177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.86 32.41 6.93 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.269 -0.967 . . . . 70.33 113.933 -175.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -139.08 100.28 3.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.069 0.435 . . . . 72.21 110.585 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 51' ' ' THR . 3.7 mp0 -55.38 -33.78 63.74 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.103 0.409 . . . . 73.12 112.103 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -56.89 -45.22 82.74 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.09 -0.337 . . . . 60.32 110.09 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.413 HD12 HG23 ' A' ' 44' ' ' ILE . 80.2 mt -78.64 -39.56 36.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.179 -0.464 . . . . 72.11 110.471 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.507 ' HB ' ' HA ' ' A' ' 48' ' ' GLU . 88.0 m -56.09 -54.03 49.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.194 -0.457 . . . . 64.53 111.679 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -59.06 -30.55 68.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.981 0.42 . . . . 74.21 110.972 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.9 mt -77.05 -53.82 7.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.906 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -116.27 -0.2 12.68 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.487 1.292 . . . . 74.24 114.487 -165.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -59.35 -39.91 84.7 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.843 1.202 . . . . 74.41 111.163 -176.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -84.65 -14.42 48.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.792 -0.64 . . . . 74.24 110.951 178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.418 ' HA ' ' HH ' ' A' ' 73' ' ' TYR . 13.0 ttm180 -143.97 54.12 1.3 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.315 -0.624 . . . . 74.3 109.315 -167.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.554 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.26 -102.66 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.522 0 CA-C-O 118.444 -0.789 . . . . 72.41 111.069 -172.206 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.554 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 16.6 Cg_exo -23.17 75.06 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 122.567 2.178 . . . . 70.34 113.693 -145.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.486 HG23 ' CB ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -102.05 115.51 44.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.719 . . . . 75.43 111.251 -169.229 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.643 HD21 HG21 ' A' ' 12' ' ' VAL . 3.0 tm? -89.19 110.25 21.03 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.572 -0.74 . . . . 74.32 109.587 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -92.25 127.15 37.63 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.111 -0.95 . . . . 74.45 110.693 -176.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.28 95.83 7.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.425 -0.807 . . . . 75.43 111.211 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 42.2 t -77.63 90.76 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.3 0.572 . . . . 72.21 109.487 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 172.19 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.844 -1.071 . . . . 70.1 108.659 -173.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -124.05 -2.59 8.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 64.24 109.928 -178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 58.71 78.74 0.24 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.098 -0.955 . . . . 71.1 112.035 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -174.33 -179.41 1.59 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.39 -0.823 . . . . 75.32 110.332 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -95.09 141.78 28.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.45 -0.341 . . . . 62.22 110.777 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -96.02 -53.9 3.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.388 0.613 . . . . 73.31 109.559 170.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.7 t -156.77 155.47 31.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.312 -0.858 . . . . 75.13 109.374 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 0.5 OUTLIER -145.09 163.8 33.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.568 -0.287 . . . . 60.25 110.382 179.253 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.42 ' O ' HD13 ' A' ' 20' ' ' LEU . 62.5 m-85 74.55 -56.63 0.63 Allowed 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.114 0.884 . . . . 71.5 110.951 -174.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -129.93 -161.95 1.16 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.007 -1.108 . . . . 71.14 108.007 -175.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.8 tp -129.85 113.48 14.71 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.079 -0.648 . . . . 74.01 111.886 -175.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -86.09 86.07 7.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.082 -0.71 . . . . 73.32 109.082 169.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.7 m -59.03 -28.23 66.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 74.41 111.381 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.46 -37.4 68.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.193 -0.458 . . . . 75.35 110.908 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 40.5 t -70.89 -46.59 67.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.193 -0.458 . . . . 72.32 110.977 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.503 HD12 HD11 ' A' ' 10' ' ' LEU . 6.9 tp -68.74 -28.18 38.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.346 -0.541 . . . . 74.25 109.992 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.78 -30.64 78.26 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 111.448 -0.661 . . . . 72.52 111.448 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.3 -33.03 64.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.187 0.517 . . . . 71.41 110.377 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -80.41 -51.42 8.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.96 -0.563 . . . . 71.35 111.038 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.472 HD22 ' HB3' ' A' ' 35' ' ' SER . 13.3 mt -64.87 -50.93 64.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.707 -0.679 . . . . 64.55 111.516 -177.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.576 0.548 . . . . 71.24 111.396 -172.943 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 109.748 -0.464 . . . . 73.2 109.748 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -62.34 158.67 39.19 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.654 2.236 . . . . 75.44 113.329 -169.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.2 mmp_? -99.2 -164.36 1.12 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.935 -0.765 . . . . 74.31 108.935 175.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.948 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 4.3 tmtp? -149.76 128.87 12.73 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.544 -0.462 . . . . 71.04 110.858 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.515 HD23 HD11 ' A' ' 61' ' ' LEU . 28.4 mt -116.78 138.67 51.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 75.02 111.294 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.579 HG22 ' HB3' ' A' ' 40' ' ' GLU . 41.2 t -124.34 136.41 60.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.701 -0.681 . . . . 71.11 110.131 175.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.587 HG21 HD22 ' A' ' 61' ' ' LEU . 78.4 t -108.35 120.42 59.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.688 -0.486 . . . . 74.44 109.688 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -83.41 97.43 8.95 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.688 -0.486 . . . . 74.52 109.688 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.18 -176.12 14.3 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.018 -1.087 . . . . 62.31 112.696 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 5.2 ptm180 -158.28 125.44 4.98 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.896 -0.409 . . . . 74.42 109.896 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 55.3 -154.99 0.28 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.963 -0.562 . . . . 70.43 111.592 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.78 145.37 17.41 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.725 -0.75 . . . . 74.53 112.762 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.402 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 51.2 t -156.28 142.81 18.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.431 -0.581 . . . . 75.23 109.431 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.461 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 18.4 m170 -60.38 -48.8 80.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 62.5 111.772 -175.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -34.65 78.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.416 -0.356 . . . . 73.12 110.699 -175.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 84.2 m -64.7 -40.63 95.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.39 . . . . 53.0 110.493 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -61.93 -40.5 95.73 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.038 -0.528 . . . . 74.03 110.218 176.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 35.9 mt-10 -64.73 -36.39 84.14 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.726 -0.67 . . . . 71.12 110.942 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.557 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 82.6 mtp -67.26 -44.69 78.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.466 -0.334 . . . . 73.33 110.432 176.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.63 -47.39 82.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.821 0.343 . . . . 74.24 110.897 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.92 87.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.112 -0.495 . . . . 74.35 110.61 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -64.89 -42.33 94.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 71.21 110.887 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 24' ' ' MET . 95.9 mt -59.31 -45.59 90.89 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 116.164 -0.471 . . . . 64.42 110.569 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 28.1 mmm180 -57.73 -42.63 84.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.39 -0.368 . . . . 73.05 111.255 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.3 -45.41 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.287 -0.415 . . . . 61.13 111.137 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.95 -32.96 65.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.914 0.388 . . . . 64.32 110.146 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -62.78 -26.77 68.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.633 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 29' ' ' ARG . 47.9 mtmt -63.36 -42.5 98.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.771 -0.65 . . . . 74.21 110.485 173.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -79.06 -37.61 38.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.056 -0.974 . . . . 73.44 110.639 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB3' HD11 ' A' ' 84' ' ' LEU . 46.1 m -145.66 124.68 12.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.527 -0.76 . . . . 75.23 109.628 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -83.72 119.49 24.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.312 0.577 . . . . 74.31 111.041 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.589 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 1.5 p90 -130.96 20.63 4.95 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.536 -0.756 . . . . 75.24 110.926 179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.45 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 9.8 mt-10 53.8 -176.83 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.349 0.595 . . . . 75.1 111.027 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.528 HD11 HD13 ' A' ' 28' ' ' LEU . 7.2 tp -152.17 134.9 15.46 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.186 -0.461 . . . . 72.21 110.031 173.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.579 ' HB3' HG22 ' A' ' 11' ' ' VAL . 10.3 tp10 -136.61 143.04 43.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.116 -0.493 . . . . 54.11 110.195 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.2 t -125.75 107.4 17.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.05 -0.722 . . . . 62.24 109.05 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.478 HD12 HG13 ' A' ' 11' ' ' VAL . 62.4 mt -107.86 116.28 50.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.721 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -75.92 106.67 7.63 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.344 -0.844 . . . . 73.33 110.251 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.4 pt -80.17 -9.83 12.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.62 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.59 -42.3 23.61 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.245 -0.889 . . . . 62.03 112.652 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.89 21.06 45.82 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.578 -0.82 . . . . 73.23 113.269 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -129.72 119.62 23.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.028 0.414 . . . . 71.21 110.607 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.23 -20.66 60.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 72.14 111.929 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -77.6 -54.77 6.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.186 0.517 . . . . 74.41 110.363 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.0 mt -65.35 -39.75 92.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.622 -0.717 . . . . 74.34 111.432 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.4 m -61.47 -39.57 91.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.988 0.423 . . . . 75.32 110.788 176.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.07 -31.49 72.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.088 0.47 . . . . 73.53 110.512 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.67 -55.62 4.02 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.741 . . . . 73.23 111.695 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.442 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 49.2 m-85 -109.42 19.55 19.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.104 0.779 . . . . 71.14 113.104 -166.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -54.82 -47.48 74.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.175 0.512 . . . . 73.41 111.285 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.98 -17.6 56.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.113 -0.494 . . . . 73.41 111.169 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.534 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 9.3 ptt180 -128.26 73.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.073 0.464 . . . . 73.33 110.628 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.44 HG21 ' HD3' ' A' ' 59' ' ' PRO . 1.2 m -90.65 -22.6 0.26 Allowed Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 113.399 0.889 . . . . 74.24 113.399 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.44 ' HD3' HG21 ' A' ' 58' ' ' VAL . 3.8 Cg_exo -79.01 49.33 3.12 Favored 'Trans proline' 0 N--CA 1.443 -1.471 0 CA-C-N 120.629 1.26 . . . . 75.0 110.246 164.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.01 131.44 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.198 -0.91 . . . . 64.44 110.16 -175.271 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.587 HD22 HG21 ' A' ' 12' ' ' VAL . 2.4 tm? -109.34 118.83 37.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.827 -0.624 . . . . 74.33 110.34 -174.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -106.67 136.71 46.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.004 -0.998 . . . . 73.5 110.842 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.542 ' HB2' ' HG ' ' A' ' 70' ' ' LEU . . . -94.52 111.06 22.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.257 -0.428 . . . . 74.43 111.085 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.948 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 60.9 t -86.33 98.76 7.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.013 0.435 . . . . 73.14 109.994 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 177.16 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.076 -1.083 . . . . 64.3 108.076 -176.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -106.16 -11.27 16.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.994 -1.003 . . . . 74.15 109.351 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 67.52 86.99 0.13 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 114.767 -1.106 . . . . 72.51 111.584 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -170.5 157.41 5.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.94 -1.027 . . . . 74.45 109.418 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -82.37 133.88 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.688 0.28 . . . . 73.23 110.399 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.542 ' HG ' ' HB2' ' A' ' 63' ' ' ALA . 53.7 mt -92.59 -46.56 7.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.016 0.436 . . . . 75.12 110.395 178.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.0 t -152.46 157.39 41.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.997 -0.547 . . . . 74.03 111.334 -171.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -128.36 128.82 45.25 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.859 -0.793 . . . . 75.43 108.859 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 67.39 143.8 0.04 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.949 0.781 . . . . 70.31 112.021 -176.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 57.91 -124.16 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.752 -1.113 . . . . 71.02 110.519 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.0 tp -171.19 110.85 0.33 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.94 -0.304 . . . . 74.52 110.732 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.65 89.6 6.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.937 0.399 . . . . 74.11 110.069 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -57.71 -27.9 63.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.333 -0.849 . . . . 73.12 112.07 -176.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.18 -46.09 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 74.31 110.861 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.09 -44.83 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.51 . . . . 71.03 111.281 -176.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.443 HD13 HD12 ' A' ' 10' ' ' LEU . 6.7 tp -64.99 -28.23 44.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.512 -0.475 . . . . 64.34 109.802 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.34 -36.27 89.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.75 -0.738 . . . . 61.02 111.662 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.98 -26.58 65.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.088 0.471 . . . . 61.11 110.785 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -87.92 -43.14 12.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 74.44 111.344 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.58 HD11 ' HB3' ' A' ' 35' ' ' SER . 1.3 mm? -76.07 -37.32 58.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.511 0.56 . . . . 75.34 112.511 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 121.156 -0.218 . . . . 55.34 110.934 -177.092 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 110.416 -0.216 . . . . 65.4 110.416 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -80.35 167.04 19.79 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.513 2.142 . . . . 74.5 113.155 -172.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.596 ' NE ' ' O ' ' A' ' 85' ' ' SER . 80.7 mtt-85 -107.55 -171.92 1.97 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.419 -0.81 . . . . 72.34 109.522 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 48.8 tttt -149.52 139.43 21.93 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.117 -0.633 . . . . 74.02 112.141 -177.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.515 HD11 HD13 ' A' ' 80' ' ' ILE . 71.2 mt -113.53 130.29 56.38 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.346 -0.843 . . . . 75.12 110.57 173.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.504 HG22 ' CG2' ' A' ' 64' ' ' VAL . 79.8 t -107.07 133.16 52.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.137 -0.69 . . . . 73.44 109.137 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.837 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 11.3 t -96.58 105.56 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 109.574 -0.528 . . . . 73.31 109.574 175.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.506 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 12.8 m-85 -78.23 98.71 5.98 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.933 -0.576 . . . . 75.22 110.256 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.66 ' HA2' ' HD3' ' A' ' 59' ' ' PRO . . . -114.31 -171.57 17.31 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.269 -0.967 . . . . 61.14 112.839 -175.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 10.1 ptm180 -161.97 103.42 1.15 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.766 -0.457 . . . . 73.11 109.766 171.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 73.82 -56.03 0.66 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.209 -0.905 . . . . 75.53 112.689 172.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.41 158.57 26.02 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.283 -0.961 . . . . 72.22 113.544 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.1 t -171.94 128.04 0.6 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.261 0.625 . . . . 74.23 109.8 177.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -68.0 -42.29 80.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.473 0.178 . . . . 72.34 111.286 -175.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 16.1 mt -61.83 -30.1 70.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.624 -0.262 . . . . 74.55 111.182 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.533 ' O ' HG13 ' A' ' 25' ' ' ILE . 51.4 t -55.93 -50.94 69.35 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.352 -0.24 . . . . 55.25 110.352 177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.24 -39.13 85.61 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.033 -0.531 . . . . 73.25 111.013 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.09 -39.34 89.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.841 -0.618 . . . . 73.43 111.136 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.49 ' HE3' ' HB3' ' A' ' 24' ' ' MET . 15.2 mtp -71.9 -39.18 69.72 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.516 -0.474 . . . . 73.51 110.311 177.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 21' ' ' CYS . 72.9 mt -54.84 -50.01 64.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 121.347 -0.141 . . . . 73.25 110.759 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.86 84.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.881 0.372 . . . . 74.3 111.17 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -66.96 -44.71 79.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.077 -0.51 . . . . 72.32 110.838 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -67.68 -32.18 72.66 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.32 -0.4 . . . . 75.22 111.31 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -57.98 -39.02 77.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.446 . . . . 73.51 110.814 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.452 ' HA ' ' CE ' ' A' ' 33' ' ' LYS . 80.4 t -67.84 -42.18 85.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.993 -0.549 . . . . 75.1 110.949 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.99 -35.08 77.74 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.808 -0.441 . . . . 75.44 109.808 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.419 ' HA ' ' O ' ' A' ' 35' ' ' SER . 23.7 tt0 -60.86 -26.59 67.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.584 -0.735 . . . . 63.43 110.656 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.452 ' CE ' ' HA ' ' A' ' 30' ' ' VAL . 54.3 mtmt -74.97 -11.23 60.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.636 -0.711 . . . . 72.34 111.383 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.11 -44.74 4.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 75.45 109.842 173.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 17.6 m -131.21 115.92 16.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.055 -177.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -77.24 132.64 38.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.123 0.487 . . . . 75.52 111.344 -177.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.583 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 16.6 p90 -139.99 19.0 2.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.708 -0.678 . . . . 75.23 111.062 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 60.82 -179.61 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.946 0.403 . . . . 64.24 111.286 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -151.14 110.59 3.98 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.28 -0.637 . . . . 74.44 109.28 173.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -121.72 145.03 48.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.513 -0.312 . . . . 54.43 110.324 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.4 117.8 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.961 -0.385 . . . . 73.03 109.961 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -133.43 128.21 54.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.459 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.642 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 98.7 m-20 -83.54 128.71 34.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 71.33 110.46 176.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' A' ' 51' ' ' THR . 20.2 pt -64.75 -47.51 88.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.208 -0.451 . . . . 75.4 109.994 175.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.41 ' N ' HG13 ' A' ' 44' ' ' ILE . 36.5 t70 44.57 -97.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.33 1.052 . . . . 74.32 113.629 173.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.09 -3.97 63.31 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.931 -0.652 . . . . 73.02 113.44 -171.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -80.93 84.35 6.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.75 -0.463 . . . . 71.21 109.75 178.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -53.27 -32.51 48.94 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 73.4 111.124 -177.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -55.4 -46.95 76.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.838 -0.619 . . . . 74.2 110.457 175.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.5 -39.88 36.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.273 -0.421 . . . . 74.55 110.876 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.554 ' HA ' HD11 ' A' ' 44' ' ' ILE . 6.9 m -56.34 -42.0 77.01 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.369 -0.378 . . . . 73.32 111.809 -177.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.22 -34.99 77.54 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.294 0.568 . . . . 72.2 111.095 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.9 mt -78.6 -48.52 14.98 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.442 -0.799 . . . . 74.43 111.33 -176.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.445 ' CD1' HG22 ' A' ' 60' ' ' VAL . 62.4 m-85 -114.18 14.79 18.25 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.031 0.752 . . . . 71.32 113.031 -167.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -53.45 -54.02 42.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.171 0.442 . . . . 75.54 111.3 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -87.8 -0.48 57.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.44 110.461 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.711 ' O ' HG21 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -108.52 5.26 25.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.716 -0.674 . . . . 73.35 110.647 -172.767 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.907 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 2.6 m -54.85 -171.24 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 114.804 1.409 . . . . 73.14 114.804 -163.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.907 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 17.6 Cg_exo -7.07 82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.428 -2.334 0 C-N-CA 122.507 2.138 . . . . 61.52 113.828 -129.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.837 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -90.53 160.26 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 122.551 0.341 . . . . 64.4 111.327 -171.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.718 ' HG ' ' HD1' ' A' ' 72' ' ' HIS . 24.6 mt -97.46 103.03 14.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.281 0.562 . . . . 62.14 109.707 169.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.546 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 70.2 t80 -93.68 128.3 39.8 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.056 -0.975 . . . . 75.11 110.777 -177.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.426 ' HB2' ' CE1' ' A' ' 83' ' ' TYR . . . -78.13 102.82 7.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.027 -0.533 . . . . 75.35 110.273 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.504 ' CG2' HG22 ' A' ' 11' ' ' VAL . 61.7 t -66.47 146.5 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.729 -0.669 . . . . 75.01 110.874 -176.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 81.0 -31.67 0.11 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.176 0.99 . . . . 73.01 112.729 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -98.76 -9.57 24.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 121.17 -0.212 . . . . 74.4 111.505 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.546 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 27.8 t70 48.08 73.47 0.21 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.48 0.657 . . . . 73.34 111.642 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -160.26 148.75 16.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 65.2 110.095 -177.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -95.95 127.62 42.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.294 -0.632 . . . . 74.41 109.294 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.09 -70.12 0.59 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.622 -0.511 . . . . 74.41 109.622 177.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 50.0 t 178.16 140.38 0.09 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.385 -0.825 . . . . 64.24 108.936 177.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.718 ' HD1' ' HG ' ' A' ' 61' ' ' LEU . 6.8 t60 -144.07 130.82 20.22 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.099 -0.64 . . . . 65.02 110.951 170.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.461 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 2.1 m-85 174.59 -70.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 125.314 1.634 . . . . 74.0 107.718 173.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -114.12 -74.52 0.62 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 73.54 110.118 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.0 tp 175.64 141.95 0.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.532 0.333 . . . . 73.14 110.162 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -95.21 -42.52 8.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.387 -0.369 . . . . 65.45 110.617 176.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 m 62.19 20.74 11.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.741 -0.663 . . . . 74.03 111.932 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -139.06 -53.27 0.57 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.615 -0.434 . . . . 70.24 111.092 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.08 -39.25 82.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 73.11 109.71 177.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.515 HD13 HD11 ' A' ' 10' ' ' LEU . 8.1 tp -66.85 -34.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.937 -0.574 . . . . 74.41 109.835 174.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.49 -37.72 94.03 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.63 -0.795 . . . . 73.34 111.242 177.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.22 81.28 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.437 -0.382 . . . . 64.41 110.759 174.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.426 ' CE1' ' HB2' ' A' ' 63' ' ' ALA . 63.7 t80 -67.66 -43.68 79.68 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.087 -0.506 . . . . 74.52 111.72 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.461 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -71.26 13.76 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.327 0.491 . . . . 74.33 112.327 -173.378 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.596 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 18.8 m . . . . . 0 C--N 1.322 -0.602 0 N-CA-C 109.775 -0.454 . . . . 74.23 109.775 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.683 -0.488 . . . . 75.41 109.683 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -76.15 157.97 37.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.661 2.241 . . . . 72.35 113.196 -167.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HD3' ' CZ ' ' A' ' 83' ' ' TYR . 48.7 mtt180 -95.1 -172.02 2.57 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.511 -0.768 . . . . 72.44 109.334 175.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 87.5 tttt -145.58 140.64 27.55 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.335 0.588 . . . . 74.33 111.685 -177.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.539 HD13 ' CD1' ' A' ' 80' ' ' ILE . 61.5 mt -116.91 129.71 56.24 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.092 -0.958 . . . . 74.21 110.427 174.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -105.82 126.66 61.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 116.017 -0.538 . . . . 74.13 109.784 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.701 HG23 HD23 ' A' ' 61' ' ' LEU . 95.9 t -96.95 114.53 34.14 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.137 -0.483 . . . . 73.51 109.949 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -91.9 122.72 34.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 72.41 110.533 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.75 166.03 26.33 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 109.818 -1.313 . . . . 62.42 109.818 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -83.44 -68.82 0.68 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 118.414 1.107 . . . . 73.34 110.093 -178.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.619 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . 1.8 mp0 -121.94 -77.24 0.59 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.2 -0.454 . . . . 51.55 110.114 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -154.04 154.91 25.83 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.389 -0.684 . . . . 72.41 111.389 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.8 t -162.5 145.66 11.32 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.843 -0.428 . . . . 74.1 109.843 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -62.85 -36.19 82.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.696 -0.229 . . . . 65.14 111.215 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -32.39 72.61 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.861 0.363 . . . . 74.32 110.759 178.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.45 ' O ' HG13 ' A' ' 25' ' ' ILE . 49.8 t -68.35 -42.1 79.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.217 -0.447 . . . . 60.55 109.8 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.37 -40.27 96.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.001 -0.545 . . . . 71.11 111.168 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -60.39 -47.06 87.73 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.109 0.481 . . . . 74.0 109.893 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.555 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.1 mtp -61.75 -49.66 75.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.732 -0.667 . . . . 74.44 111.373 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 21' ' ' CYS . 75.0 mt -55.84 -45.63 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.854 -0.157 . . . . 72.14 111.4 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -37.15 78.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.986 0.422 . . . . 74.52 110.93 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.5 m -69.71 -38.4 76.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.61 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 24' ' ' MET . 82.3 mt -63.76 -39.29 93.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 72.33 110.828 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.41 -38.29 80.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.097 0.475 . . . . 75.33 110.701 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.96 -38.56 72.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.863 -0.608 . . . . 73.34 110.418 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.461 HD21 ' HA ' ' A' ' 31' ' ' LEU . 10.5 mt -67.67 -32.65 73.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 74.32 111.438 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.5 mt-30 -59.63 -20.99 59.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.901 0.381 . . . . 63.34 111.432 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.73 -33.1 64.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 62.45 110.992 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.73 -38.64 11.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.171 0.51 . . . . 75.43 110.489 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.593 ' HB3' HD12 ' A' ' 84' ' ' LEU . 36.2 m -147.34 113.78 5.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.827 -0.624 . . . . 72.21 109.983 -177.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.84 128.54 33.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.025 0.441 . . . . 75.22 110.983 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.572 ' HB3' HD21 ' A' ' 84' ' ' LEU . 3.9 p90 -136.61 21.94 3.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.635 -0.711 . . . . 70.54 110.651 177.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 58.51 -176.8 0.08 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.128 0.49 . . . . 64.05 110.576 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.7 tp -152.62 109.84 3.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.4 -0.363 . . . . 74.15 110.197 170.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.424 ' OE2' HD11 ' A' ' 42' ' ' ILE . 33.2 tt0 -121.31 118.73 30.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.046 -0.525 . . . . 64.53 109.593 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -106.9 112.31 39.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.612 -0.514 . . . . 64.43 109.612 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.424 HD11 ' OE2' ' A' ' 40' ' ' GLU . 65.9 mt -111.2 116.66 53.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.025 -0.534 . . . . 74.13 110.727 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.619 ' ND2' ' HA ' ' A' ' 16' ' ' GLU . 14.6 m120 -76.55 116.98 17.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.809 -0.632 . . . . 75.43 111.06 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.576 HD13 ' HA ' ' A' ' 51' ' ' THR . 17.9 pt -77.04 -38.65 28.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.965 -0.561 . . . . 74.45 109.83 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.1 t70 32.33 -96.42 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.575 1.172 . . . . 71.13 112.988 -177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.74 34.79 3.63 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.861 -0.685 . . . . 40.1 112.469 -177.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.18 116.81 23.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.584 -0.525 . . . . 72.14 109.584 176.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -57.01 -25.05 57.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.849 0.685 . . . . 55.21 112.849 -174.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -77.8 -58.09 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.354 -0.538 . . . . 73.23 110.768 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.5 mt -78.78 -39.58 35.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.61 0.596 . . . . 74.34 112.61 -172.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.576 ' HA ' HD13 ' A' ' 44' ' ' ILE . 87.9 m -60.69 -48.76 80.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.834 0.35 . . . . 73.14 110.966 -178.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -64.43 -29.39 70.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.916 0.389 . . . . 74.34 110.912 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.5 mt -80.09 -50.67 10.01 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.386 0.513 . . . . 75.3 112.386 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -109.04 -1.87 18.58 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.328 1.233 . . . . 74.14 114.328 -165.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -73.19 89.25 1.51 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.916 0.78 . . . . 72.21 112.004 -175.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -136.75 -85.42 0.33 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.308 -0.86 . . . . 72.34 109.177 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -139.59 81.44 1.83 Allowed 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 105.761 -1.941 . . . . 75.55 105.761 171.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.475 ' O ' HG22 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -51.09 -84.86 0.0 OUTLIER Pre-proline 0 CA--C 1.507 -0.685 0 CA-C-N 114.435 -1.257 . . . . 63.51 114.365 -157.203 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.446 ' HD3' HG22 ' A' ' 58' ' ' VAL . 51.0 Cg_exo -21.08 78.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.569 0 C-N-CA 122.718 2.279 . . . . 74.43 114.223 -144.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.554 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -99.56 133.41 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.592 -0.731 . . . . 75.43 111.267 -170.374 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.701 HD23 HG23 ' A' ' 12' ' ' VAL . 58.1 mt -88.27 106.48 18.24 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.294 0.568 . . . . 74.13 109.694 170.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -91.31 121.97 33.52 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.309 -0.86 . . . . 74.24 109.868 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.5 100.89 6.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.85 -0.614 . . . . 70.32 110.465 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 52.8 t -67.89 161.57 3.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.315 -0.624 . . . . 75.44 109.315 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 79.68 -46.81 0.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.184 0.594 . . . . 74.23 111.618 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -94.3 -26.39 16.61 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.807 0.337 . . . . 73.53 110.258 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 60.99 82.21 0.17 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.316 -0.856 . . . . 72.51 111.791 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -165.11 166.41 19.13 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.261 -0.881 . . . . 74.0 110.112 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -94.17 127.98 40.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 72.44 110.393 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.4 mt -100.91 -82.19 0.46 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.537 0.684 . . . . 71.5 111.733 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 37.8 t -135.8 148.69 48.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.167 -0.924 . . . . 75.44 110.65 -169.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -145.2 163.19 35.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.74 -0.209 . . . . 75.14 111.236 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 82.85 -77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.616 0.969 . . . . 72.4 113.616 171.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -114.46 -0.35 13.78 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.737 0.643 . . . . 75.25 112.737 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.6 tp 66.93 108.27 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.673 . . . . 75.42 111.371 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -80.68 -21.8 40.99 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 54.12 110.8 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.7 m 70.82 -54.19 0.66 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.704 0.627 . . . . 75.33 111.809 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -60.39 -45.6 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.005 0.372 . . . . 74.52 112.005 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.13 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 75.44 111.977 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.812 HD12 HD22 ' A' ' 84' ' ' LEU . 5.5 tp -71.84 -34.53 51.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 C-N-CA 120.3 -0.56 . . . . 75.23 109.804 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.35 -35.25 90.69 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.649 -0.786 . . . . 74.32 111.731 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.32 72.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.984 0.421 . . . . 74.12 111.191 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.455 ' CZ ' ' HD3' ' A' ' 8' ' ' ARG . 20.2 t80 -87.76 -47.73 8.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.452 . . . . 75.12 111.712 178.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.812 HD22 HD12 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -69.46 -37.43 77.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.102 -0.499 . . . . 74.05 111.889 -171.396 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 110.487 -0.19 . . . . 75.31 110.487 -179.329 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.445 -0.69 0 CA-C-O 120.828 0.347 . . . . 72.54 110.935 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.35 152.9 61.35 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.871 2.381 . . . . 64.24 113.282 -173.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' ' O ' ' A' ' 85' ' ' SER . 2.4 ptp180 -115.24 150.04 36.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.264 -0.88 . . . . 74.23 108.64 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 47.1 mtpt -100.38 135.96 41.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.643 0.609 . . . . 75.45 112.643 -172.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 HD11 ' A' ' 80' ' ' ILE . 73.5 mt -103.63 130.52 51.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.372 -0.831 . . . . 73.13 110.038 170.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.573 HG21 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -107.9 128.64 63.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.981 -0.554 . . . . 72.35 110.445 175.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.504 HG22 HD21 ' A' ' 61' ' ' LEU . 86.2 t -96.46 119.5 44.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 109.106 -0.701 . . . . 74.43 109.106 174.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -78.47 97.02 5.55 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.015 0.436 . . . . 73.1 110.811 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.528 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -80.44 160.62 43.98 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.81 -0.71 . . . . 75.25 112.539 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.62 ' CB ' HG12 ' A' ' 58' ' ' VAL . 34.9 ttp180 -144.94 -0.67 0.89 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.077 -0.712 . . . . 74.14 109.077 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 59.18 170.66 0.07 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 114.731 -1.122 . . . . 71.1 111.033 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.23 -56.94 4.88 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.808 -0.711 . . . . 55.45 113.632 175.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.17 113.47 6.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.085 0.469 . . . . 73.22 110.97 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -71.46 -28.29 63.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.871 -0.604 . . . . 74.41 111.198 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.4 -30.19 51.36 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.624 0.231 . . . . 75.22 111.624 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.416 ' O ' HG13 ' A' ' 25' ' ' ILE . 71.0 m -56.08 -38.74 71.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.671 0.272 . . . . 71.42 110.731 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -71.29 -33.46 69.75 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.731 0.3 . . . . 75.23 110.629 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.24 -45.05 80.17 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.081 -0.509 . . . . 75.22 110.077 175.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.604 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.7 mmm -67.0 -41.47 86.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.517 -0.765 . . . . 74.55 110.137 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 21' ' ' CYS . 79.1 mt -56.82 -45.26 83.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 115.938 -0.573 . . . . 71.05 110.805 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.45 87.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.903 0.382 . . . . 75.11 110.69 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -61.59 -42.86 99.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 54.2 110.958 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 24' ' ' MET . 73.8 mt -64.06 -37.6 88.04 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.209 -0.45 . . . . 75.2 110.915 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -61.24 -42.4 98.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.254 -0.43 . . . . 75.03 110.893 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 97.9 t -71.61 -39.43 69.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.622 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.425 HD22 ' HA ' ' A' ' 31' ' ' LEU . 14.2 mt -66.71 -34.79 78.62 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.377 -0.374 . . . . 75.31 111.443 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -59.87 -20.99 60.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 73.12 111.37 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -82.02 -15.86 52.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 74.22 111.191 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -106.43 -46.2 4.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.481 0.658 . . . . 71.33 109.743 178.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.523 ' HB3' HD11 ' A' ' 84' ' ' LEU . 50.9 m -141.19 113.22 7.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.884 -1.053 . . . . 72.15 109.319 -175.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -79.22 129.22 34.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.989 0.423 . . . . 64.52 111.7 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HB3' HD12 ' A' ' 84' ' ' LEU . 3.1 p90 -138.27 18.42 2.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.997 -0.547 . . . . 74.4 111.282 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 57.84 -178.55 0.06 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.329 0.585 . . . . 73.11 111.159 -176.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.8 tp -150.7 117.3 5.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.053 -0.521 . . . . 74.22 110.36 171.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.573 ' HB3' HG21 ' A' ' 11' ' ' VAL . 29.7 tt0 -126.47 123.51 38.0 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.557 -0.747 . . . . 71.3 109.568 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.1 t -104.74 120.25 54.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.472 -0.331 . . . . 62.23 110.153 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.492 HD13 HG11 ' A' ' 11' ' ' VAL . 75.7 mt -124.71 110.41 24.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.381 -0.372 . . . . 62.52 110.333 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.528 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.2 m120 -69.62 122.81 19.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.265 0.555 . . . . 75.23 111.829 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.403 HD12 ' HA ' ' A' ' 51' ' ' THR . 44.8 pt -86.57 -10.05 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.856 -0.611 . . . . 72.2 110.445 178.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.426 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 5.6 p-10 -73.53 -7.12 50.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.014 0.435 . . . . 74.53 110.32 177.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.36 -2.95 58.83 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.156 -0.778 . . . . 74.33 111.156 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -131.59 97.52 4.25 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.426 -0.583 . . . . 65.21 109.426 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.92 -24.67 67.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.307 0.855 . . . . 54.34 113.307 -169.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -75.27 -41.67 56.73 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.231 -0.588 . . . . 71.32 110.171 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.91 -31.5 72.7 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.51 -0.313 . . . . 75.5 110.594 173.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.403 ' HA ' HD12 ' A' ' 44' ' ' ILE . 45.5 m -53.43 -57.16 11.62 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.069 -0.514 . . . . 54.2 111.326 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.0 mtt-85 -63.93 -31.28 72.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.025 0.44 . . . . 71.23 111.62 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.7 mt -68.11 -39.86 82.69 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.333 0.494 . . . . 72.11 112.333 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -131.47 19.34 4.77 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 112.44 0.533 . . . . 75.42 112.44 -172.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -52.13 -53.35 43.8 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.051 0.453 . . . . 75.42 111.846 -176.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -93.25 11.88 26.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.749 -0.659 . . . . 72.5 110.365 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.734 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 72.7 mtm180 -135.49 50.82 2.1 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.773 -0.825 . . . . 75.33 108.773 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.62 HG12 ' CB ' ' A' ' 15' ' ' ARG . 1.4 m -89.27 -24.28 0.29 Allowed Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 114.078 1.14 . . . . 75.15 114.078 -178.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.466 ' HD3' HG21 ' A' ' 58' ' ' VAL . 8.3 Cg_exo -75.08 52.02 2.97 Favored 'Trans proline' 0 N--CA 1.44 -1.64 0 CA-C-N 121.025 1.402 . . . . 74.01 110.039 165.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.734 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.4 OUTLIER -111.46 150.53 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 CA-C-N 114.893 -1.049 . . . . 73.33 110.141 -171.048 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.504 HD21 HG22 ' A' ' 12' ' ' VAL . 91.6 mt -113.28 122.14 46.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.896 0.379 . . . . 73.53 111.18 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.542 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 91.2 t80 -99.61 125.26 45.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.965 -0.561 . . . . 73.51 109.931 175.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' HD22 ' A' ' 70' ' ' LEU . . . -84.88 106.95 16.78 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.895 0.379 . . . . 74.41 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 97.3 t -78.89 93.83 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.04 -0.527 . . . . 74.23 110.093 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 170.89 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 72.43 109.206 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -119.64 -11.63 9.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.596 -0.729 . . . . 74.12 111.026 -176.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 66.69 89.57 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.429 0.633 . . . . 75.44 109.725 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -167.9 150.57 5.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 75.15 109.913 -175.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.76 135.41 34.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.753 -0.462 . . . . 72.53 109.753 175.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 63' ' ' ALA . 3.1 mm? -79.14 -70.99 0.47 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.779 -0.646 . . . . 75.44 110.496 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.469 ' SG ' HD13 ' A' ' 75' ' ' LEU . 8.4 p -152.97 -178.91 7.21 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.388 -0.824 . . . . 73.21 110.101 -178.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -118.38 -170.93 1.98 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.851 -0.613 . . . . 61.44 110.242 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.429 ' HB3' ' CG ' ' A' ' 59' ' ' PRO . 21.1 p90 -41.9 135.16 2.43 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 123.769 0.668 . . . . 75.44 111.378 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 71.87 94.13 0.08 Allowed 'General case' 0 C--O 1.231 0.127 0 O-C-N 124.119 0.887 . . . . 73.3 109.353 -173.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.544 ' HA ' ' HE2' ' A' ' 24' ' ' MET . 38.4 tp -53.58 123.86 13.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.07 -1.423 . . . . 72.45 113.849 -166.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.9 94.24 6.45 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.081 -1.081 . . . . 72.11 108.081 167.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.1 m -67.85 -36.43 80.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 72.52 111.515 -169.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.55 -43.46 98.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.341 . . . . 61.55 111.228 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.2 -46.92 86.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.159 -0.473 . . . . 72.22 111.598 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.596 HD11 HD22 ' A' ' 84' ' ' LEU . 7.8 tp -66.93 -37.22 78.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.034 -0.666 . . . . 74.04 110.431 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.85 -37.2 93.31 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.578 -0.82 . . . . 61.3 111.661 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -47.46 83.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.879 0.371 . . . . 75.24 110.843 177.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -72.6 -34.25 67.27 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.002 -0.545 . . . . 74.52 111.767 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.596 HD22 HD11 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -84.41 11.05 9.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.409 -0.359 . . . . 75.45 111.859 -174.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.774 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.162 -0.681 . . . . 65.43 109.162 172.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 CA--C 1.535 0.373 0 N-CA-C 109.324 -0.621 . . . . 74.3 109.324 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.8 154.51 48.73 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.057 1.838 . . . . 74.15 113.153 -174.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.899 ' NH1' ' O ' ' A' ' 85' ' ' SER . 9.5 ptp180 -109.54 116.22 31.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.746 -0.661 . . . . 73.15 109.602 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -74.78 140.12 43.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.877 0.695 . . . . 74.21 112.877 -168.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 HD13 ' A' ' 80' ' ' ILE . 32.8 mt -113.08 145.89 40.12 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.203 -0.908 . . . . 74.34 110.736 172.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.546 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.9 t -119.73 138.53 50.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.004 -0.544 . . . . 71.31 109.937 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.693 HG22 HD21 ' A' ' 61' ' ' LEU . 65.9 t -113.57 119.97 62.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 N-CA-C 110.165 -0.309 . . . . 74.43 110.165 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CB ' HG22 ' A' ' 60' ' ' VAL . 63.8 m-85 -83.64 113.87 21.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.526 -0.546 . . . . 75.31 109.526 174.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -124.01 -173.74 13.97 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.617 -0.593 . . . . 74.22 111.617 -177.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -159.2 154.89 26.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.821 0.343 . . . . 74.31 110.715 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -73.44 72.62 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.541 -0.754 . . . . 71.12 109.686 174.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.56 61.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.672 -0.695 . . . . 73.45 111.926 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.4 t -172.06 114.37 0.33 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.889 -0.782 . . . . 63.43 108.889 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -70.99 -35.46 72.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.345 -0.389 . . . . 65.14 111.826 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 20' ' ' LEU . 37.1 mt -52.95 -29.2 27.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.929 0.714 . . . . 70.23 112.929 -172.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 62.6 m -54.99 -32.93 62.12 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.623 0.249 . . . . 73.02 111.045 178.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -64.15 -50.34 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.381 -0.372 . . . . 63.24 110.401 178.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -55.12 -49.44 71.75 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.518 -0.764 . . . . 54.15 111.241 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.524 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 63.7 mtp -59.09 -54.28 48.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 71.14 111.115 -179.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 84.1 mt -56.12 -50.59 69.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 73.52 111.407 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -37.81 73.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.958 0.409 . . . . 72.42 111.142 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.4 m -69.11 -43.48 74.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 65.54 110.879 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 24' ' ' MET . 80.4 mt -65.38 -38.38 89.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.03 111.424 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -58.07 -35.65 71.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 74.32 111.01 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.7 t -77.32 -32.71 19.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.328 -0.396 . . . . 75.3 110.608 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -30.68 66.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.037 0.446 . . . . 75.23 109.859 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.6 mt-30 -59.93 -20.83 59.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.88 -0.6 . . . . 71.41 111.252 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -81.21 -15.54 55.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 74.31 110.855 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -96.97 -49.29 5.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.319 -0.623 . . . . 65.32 109.319 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 17.9 m -140.88 119.8 12.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.025 -0.989 . . . . 72.34 109.366 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -79.26 131.68 36.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.039 0.447 . . . . 74.44 110.618 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.524 ' CD1' HD13 ' A' ' 10' ' ' LEU . 9.1 p90 -139.15 16.58 2.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.806 -0.634 . . . . 75.22 111.582 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 59.94 178.5 0.09 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.991 0.424 . . . . 72.24 110.611 -176.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.9 tp -153.19 110.12 3.45 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 120.264 -0.574 . . . . 72.43 110.88 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -115.87 118.63 33.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.97 -0.559 . . . . 72.43 109.97 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -105.4 113.84 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 110.085 -0.339 . . . . 65.02 110.085 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.7 mt -113.05 114.85 48.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.148 -0.478 . . . . 74.44 110.869 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -73.04 118.24 15.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.659 -0.701 . . . . 72.53 111.509 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 50' ' ' LEU . 28.9 pt -86.11 -25.27 6.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.07 -0.514 . . . . 73.33 111.804 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -67.49 -23.51 65.49 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.978 0.418 . . . . 74.02 111.55 -172.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.89 19.38 30.11 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.993 -0.622 . . . . 74.24 111.828 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -142.27 119.39 11.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.378 -0.601 . . . . 63.44 109.378 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -55.52 -37.52 68.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 74.22 111.26 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.51 -52.75 9.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.158 -0.473 . . . . 65.13 110.966 -174.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.417 HD21 HD13 ' A' ' 53' ' ' LEU . 48.4 mt -64.11 -33.73 76.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.519 -0.31 . . . . 71.43 111.573 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.1 m -57.85 -53.21 60.77 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 120.845 0.355 . . . . 64.54 110.368 175.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.88 -31.48 72.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.27 -0.423 . . . . 74.31 111.402 -178.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.417 HD13 HD21 ' A' ' 50' ' ' LEU . 72.1 mt -71.55 -48.35 49.08 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.381 0.512 . . . . 74.43 112.381 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.537 ' CD2' HG21 ' A' ' 60' ' ' VAL . 89.6 m-85 -113.94 8.59 17.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.28 0.844 . . . . 75.32 113.28 -169.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -59.66 135.86 57.81 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.398 -0.521 . . . . 75.04 111.478 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.3 t70 74.86 -30.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 71.44 112.903 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -116.03 37.24 3.73 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 108.364 -0.976 . . . . 75.15 108.364 -175.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.573 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.67 -97.57 0.0 OUTLIER Pre-proline 0 N--CA 1.425 -1.717 0 CA-C-N 115.276 -0.875 . . . . 74.5 110.228 -176.228 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.573 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 65.8 Cg_exo -17.74 75.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 122.535 2.157 . . . . 72.14 113.288 -146.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.548 HG13 ' O ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -111.3 126.16 68.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.916 -1.038 . . . . 70.42 111.699 -165.546 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.693 HD21 HG22 ' A' ' 12' ' ' VAL . 21.5 mt -89.62 112.87 24.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.882 -0.599 . . . . 75.21 110.72 176.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.58 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.0 t80 -91.79 120.28 32.37 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.522 -0.763 . . . . 72.15 109.761 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.87 102.82 11.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.945 -0.57 . . . . 72.21 110.196 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.0 t -63.94 146.83 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.145 -0.687 . . . . 64.34 109.145 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 85.18 -29.06 0.08 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.157 0.983 . . . . 75.05 111.047 -177.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.681 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 28.0 mt-10 -96.7 -37.01 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.26 -0.176 . . . . 74.51 111.236 176.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 18.2 t70 68.93 77.77 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.791 0.682 . . . . 75.35 109.896 -176.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.681 ' HD3' ' HB3' ' A' ' 66' ' ' GLU . 16.4 ptmt -179.77 157.82 0.75 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.36 -0.837 . . . . 73.14 109.674 -174.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mp0 -94.9 141.19 28.93 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.566 -0.531 . . . . 74.55 109.566 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 63.4 mt -84.07 -66.16 0.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.447 0.642 . . . . 74.34 110.036 176.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 19.3 t -144.29 170.76 15.39 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.865 -0.791 . . . . 74.51 108.865 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.532 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 1.5 p-80 -144.36 174.65 10.73 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 123.006 0.191 . . . . 74.54 111.503 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 80.05 -81.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.173 0.989 . . . . 74.25 112.256 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -112.37 -84.5 0.58 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 121.023 -0.271 . . . . 62.33 110.846 -173.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.4 tp 178.35 147.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.126 -0.488 . . . . 72.21 110.016 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.516 ' O ' HG21 ' A' ' 80' ' ' ILE . 18.6 t70 -141.12 109.74 5.99 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.498 -0.556 . . . . 73.44 109.498 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 -27.88 69.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.829 -0.623 . . . . 72.43 111.659 -174.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -73.84 -49.53 24.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.967 -0.56 . . . . 65.24 111.446 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.21 -46.97 89.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 74.53 111.796 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.719 HD13 HD23 ' A' ' 84' ' ' LEU . 7.0 tp -69.42 -30.5 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.856 -0.737 . . . . 72.15 109.985 177.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -19.97 67.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.047 -0.597 . . . . 53.22 111.8 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.79 -35.21 60.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.127 0.489 . . . . 64.33 110.231 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -86.53 -40.12 15.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 74.02 111.057 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.719 HD23 HD13 ' A' ' 80' ' ' ILE . 1.7 mm? -85.74 13.51 7.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.4 -0.363 . . . . 71.14 111.404 -178.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.899 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 4.4 t . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.502 -0.555 . . . . 75.31 109.502 176.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.448 -0.573 0 N-CA-C 109.911 -0.403 . . . . 74.23 109.911 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.99 121.28 4.43 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.632 2.221 . . . . 62.34 112.477 -175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -102.99 119.08 38.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.426 -0.806 . . . . 73.51 109.741 177.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 57.6 mtpt -73.03 139.0 46.29 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.992 -0.549 . . . . 74.02 112.239 -172.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.53 HD11 HD12 ' A' ' 80' ' ' ILE . 22.3 mt -105.77 119.12 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.286 -0.87 . . . . 72.12 109.923 170.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.575 HG22 ' HB3' ' A' ' 40' ' ' GLU . 80.9 t -102.07 129.89 52.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.868 -0.605 . . . . 74.43 109.982 177.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.527 HG23 ' CD2' ' A' ' 61' ' ' LEU . 46.3 t -96.33 107.06 19.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 116.068 -0.515 . . . . 75.53 109.731 176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.594 ' CB ' HG22 ' A' ' 60' ' ' VAL . 20.2 m-85 -81.48 116.89 21.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.396 -0.594 . . . . 75.43 109.396 174.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -147.93 -151.8 5.53 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.286 -0.726 . . . . 63.52 111.286 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.4 ptm180 -171.26 164.64 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.96 0.41 . . . . 73.4 110.743 176.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.13 131.09 48.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.531 -0.759 . . . . 74.41 110.704 175.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.81 -7.55 55.44 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 45.1 112.863 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -104.53 102.87 12.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.123 0.487 . . . . 73.12 109.827 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -64.61 -33.11 75.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.717 -0.674 . . . . 74.32 110.634 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -59.31 -31.57 69.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.389 -0.369 . . . . 71.32 111.56 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.466 ' O ' HG13 ' A' ' 25' ' ' ILE . 68.3 m -61.04 -42.04 97.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.977 0.418 . . . . 64.32 110.32 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -70.53 -35.13 72.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.02 -0.536 . . . . 71.45 110.47 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.49 -34.34 77.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.733 -0.667 . . . . 73.35 110.686 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.1 mtt -64.54 -43.97 92.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.098 -0.501 . . . . 73.35 110.893 173.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.6 mt -54.68 -53.25 33.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.315 -0.402 . . . . 75.54 110.92 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.18 -31.07 68.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.444 -0.344 . . . . 74.1 111.416 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.7 m -73.33 -46.24 50.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.216 -0.447 . . . . 72.11 110.721 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.467 HD12 HD12 ' A' ' 61' ' ' LEU . 9.2 mp -64.94 -35.91 82.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.197 -0.456 . . . . 75.03 111.604 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -56.61 -34.06 66.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.013 0.435 . . . . 75.32 111.257 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.7 t -76.79 -40.23 31.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.086 -0.506 . . . . 73.23 110.748 178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.453 HD22 ' HA ' ' A' ' 31' ' ' LEU . 10.5 mt -62.81 -34.71 77.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.525 -0.307 . . . . 75.04 111.024 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -53.93 -29.34 41.86 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.49 0.494 . . . . 72.11 111.444 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -77.23 -11.76 59.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.888 -0.596 . . . . 75.34 111.391 -176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -108.81 -45.84 3.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.527 0.68 . . . . 72.11 109.496 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.518 ' HB3' HD11 ' A' ' 84' ' ' LEU . 44.4 m -137.39 124.08 21.08 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.02 -0.991 . . . . 74.52 109.629 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -84.23 134.25 34.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.065 0.459 . . . . 75.43 111.597 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 9.5 p90 -147.79 18.23 1.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.769 -0.651 . . . . 73.51 110.957 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 58.53 -169.26 0.13 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.561 -0.29 . . . . 72.44 110.468 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.62 131.03 13.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.796 -0.446 . . . . 61.12 109.796 175.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HB3' HG22 ' A' ' 11' ' ' VAL . 5.1 tt0 -146.36 128.23 15.4 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.565 -0.532 . . . . 72.33 109.565 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.2 t -118.9 119.39 60.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.892 -0.41 . . . . 71.34 109.892 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 71.3 mt -127.7 126.15 66.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.466 -0.334 . . . . 74.03 110.971 -174.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 94.8 m-20 -76.98 126.95 31.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.591 . . . . 71.4 111.094 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.7 pp -79.06 -23.64 12.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 74.52 111.52 -178.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -79.17 -5.48 54.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 74.13 111.067 -175.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.69 -6.58 63.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.791 -0.719 . . . . 71.04 111.762 174.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -127.19 123.92 37.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.653 0.263 . . . . 75.45 110.85 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -50.92 -47.37 60.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 71.22 111.492 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -61.12 -48.88 79.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.386 . . . . 75.5 110.818 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.0 mt -73.23 -31.38 64.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.964 -0.562 . . . . 70.01 111.694 -172.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.656 ' O ' ' HB3' ' A' ' 55' ' ' ASN . 31.1 m -61.26 -51.69 67.89 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 121.16 0.505 . . . . 73.34 110.334 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -61.11 -30.74 70.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.916 -0.584 . . . . 71.22 111.112 -177.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.77 -34.27 24.82 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.034 0.753 . . . . 72.52 113.034 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -135.85 10.97 3.38 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.443 -0.503 . . . . 75.01 112.283 -165.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.656 ' HB3' ' O ' ' A' ' 51' ' ' THR . 2.7 p-10 -46.07 -39.09 8.81 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.251 0.834 . . . . 70.12 113.251 -172.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -131.0 21.6 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.641 0.734 . . . . 73.24 110.932 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.1 ttm180 -146.17 44.4 1.24 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.528 -1.286 . . . . 73.32 107.528 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.533 ' O ' HG11 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -78.2 -98.1 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.52 0 CA-C-N 115.199 -0.91 . . . . 73.24 111.275 -171.885 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.693 ' O ' ' HA ' ' A' ' 72' ' ' HIS . 73.0 Cg_exo -20.17 76.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.29 0 C-N-CA 122.504 2.136 . . . . 74.15 113.646 -145.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.594 HG22 ' CB ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -110.42 121.28 62.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 115.24 -0.891 . . . . 71.04 111.179 -170.521 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.527 ' CD2' HG23 ' A' ' 12' ' ' VAL . 38.9 mt -83.25 107.55 15.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.15 -0.477 . . . . 71.2 110.742 176.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -92.33 122.54 34.89 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.829 -0.623 . . . . 71.43 110.418 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.08 102.35 10.96 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.728 -0.669 . . . . 61.42 111.208 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.15 87.29 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.306 0.574 . . . . 73.43 110.184 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 172.32 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.764 -1.107 . . . . 75.12 108.233 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -99.15 -19.54 17.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.879 -1.055 . . . . 75.13 109.862 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.7 t70 67.37 78.41 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.122 -0.945 . . . . 72.12 111.029 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.98 149.32 0.9 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.042 -0.526 . . . . 73.53 110.445 174.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.57 140.09 34.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.941 -0.572 . . . . 75.24 110.415 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -91.6 -81.63 0.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.02 0.438 . . . . 75.32 110.838 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.4 p -122.82 164.45 18.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.113 -0.494 . . . . 73.4 109.85 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.693 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.4 p-80 -144.83 168.03 21.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.43 0.53 . . . . 62.23 112.43 -176.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 74.74 -82.5 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.241 1.016 . . . . 75.33 112.231 -179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -99.48 -79.51 0.49 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.77 -0.372 . . . . 75.14 110.512 -176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HA ' HD12 ' A' ' 75' ' ' LEU . 22.2 tp 171.21 147.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.888 0.743 . . . . 65.44 109.716 176.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -123.68 115.37 21.32 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.675 -0.861 . . . . 73.14 108.675 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.7 p -82.04 -2.63 52.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.981 -0.554 . . . . 74.22 112.364 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -107.43 -39.45 5.64 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.94 -0.304 . . . . 74.44 111.092 -176.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.72 -45.04 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.601 -0.272 . . . . 75.43 110.69 176.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.53 HD12 HD11 ' A' ' 10' ' ' LEU . 7.3 tp -68.34 -31.47 51.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.532 -0.467 . . . . 74.44 110.09 176.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.12 -34.51 86.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.646 -0.788 . . . . 75.41 111.704 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.95 -36.7 72.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.987 0.422 . . . . 63.33 110.492 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -81.34 -47.25 13.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.898 -0.592 . . . . 71.23 111.837 -177.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.525 HD23 HD12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -79.11 13.41 1.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.08 0.4 . . . . 74.13 112.08 -172.045 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.765 -0.457 . . . . 65.14 109.765 176.536 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.675 0.274 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -109.71 156.27 20.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.831 0.348 . . . . 0.0 110.285 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -171.58 114.49 0.37 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -63.9 145.75 55.26 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.2 m -81.58 176.54 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.932 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -77.04 145.98 74.53 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.01 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -81.39 173.95 11.09 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.786 2.324 . . . . 0.0 113.044 -171.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -103.75 140.47 37.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.415 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 0.5 OUTLIER -86.66 146.96 26.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 -176.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 61' ' ' LEU . 96.3 mt -122.16 137.65 54.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.355 0.598 . . . . 0.0 111.216 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.501 HG21 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -119.35 139.62 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.144 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 53.0 t -110.89 114.01 45.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 120.923 0.392 . . . . 0.0 110.133 175.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -82.31 132.57 35.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.165 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.61 -163.58 13.56 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -157.47 121.37 4.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.93 -171.39 0.16 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.475 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.16 98.14 2.21 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.23 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.44 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 38.8 t -108.1 142.36 38.41 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -60.28 -44.44 95.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.43 -35.18 71.7 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.184 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.503 ' O ' HG13 ' A' ' 25' ' ' ILE . 77.9 m -62.51 -49.99 73.17 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 175.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.65 -44.11 93.67 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.326 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.684 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 81.1 mtp -69.09 -37.95 78.7 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.918 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 21' ' ' CYS . 71.5 mt -56.91 -48.92 80.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 175.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.409 ' O ' HG21 ' A' ' 30' ' ' VAL . . . -59.53 -41.17 89.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.651 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.7 m -61.42 -46.7 89.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.899 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.477 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 93.2 mt -72.61 -31.31 65.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.381 -177.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -63.61 -39.02 93.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.921 0.391 . . . . 0.0 110.393 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 26' ' ' ALA . 91.7 t -65.95 -44.9 92.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.31 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.45 HD21 ' HA ' ' A' ' 31' ' ' LEU . 11.9 mt -62.73 -35.6 80.27 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.527 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.425 ' HA ' ' O ' ' A' ' 35' ' ' SER . 40.0 mt-30 -58.68 -21.38 54.27 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -74.69 -30.91 61.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.026 0.441 . . . . 0.0 110.738 177.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -91.17 -46.52 8.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.095 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.564 ' HB3' HD12 ' A' ' 84' ' ' LEU . 23.2 m -138.5 115.86 11.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.66 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -78.59 131.9 36.92 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.538 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.477 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 3.6 p90 -145.46 13.8 1.39 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 57.64 179.86 0.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.516 -175.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 tp -152.02 114.74 4.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.501 ' HB3' HG21 ' A' ' 11' ' ' VAL . 13.2 tt0 -129.64 120.34 25.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.309 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.3 116.86 45.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.954 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.5 mt -114.22 130.15 68.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -175.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -74.98 119.53 19.28 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.623 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.522 HD11 ' HA ' ' A' ' 51' ' ' THR . 20.6 pt -88.12 -15.52 9.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.118 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -54.81 -37.26 65.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.372 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.94 -51.12 15.72 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.978 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -82.01 93.81 7.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.018 0.437 . . . . 0.0 110.739 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.91 -18.94 65.67 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.257 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.56 -43.42 98.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 171.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.71 -36.93 73.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.296 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.522 ' HA ' HD11 ' A' ' 44' ' ' ILE . 92.0 m -64.35 -34.85 79.1 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.582 176.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.3 -35.71 81.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.157 0.503 . . . . 0.0 109.866 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.61 -51.02 21.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.399 178.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -108.65 -64.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.888 -170.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.2 t30 55.37 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.349 0.66 . . . . 0.0 112.152 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -84.07 -29.27 26.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 -174.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HA ' ' CE1' ' A' ' 73' ' ' TYR . 1.1 mpt_? -95.26 66.87 2.94 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.667 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -85.73 -122.71 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.632 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.751 179.059 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.667 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 88.3 Cg_exo -10.33 66.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.449 2.1 . . . . 0.0 113.409 -142.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.576 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -91.71 127.0 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.971 -167.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.548 HD13 HD13 ' A' ' 10' ' ' LEU . 2.4 tm? -91.17 103.7 16.35 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.385 -177.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.48 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 79.2 t80 -95.57 136.89 35.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.754 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.54 109.3 20.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 21.4 t -85.72 153.69 3.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 71.71 22.09 4.1 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -173.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -157.44 -39.38 0.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.072 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 69.96 60.15 0.26 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.245 172.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.408 ' HZ3' ' HB3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -156.58 158.67 37.52 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.022 176.391 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -82.93 139.09 33.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.0 mt -105.23 -64.52 1.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.444 0.64 . . . . 0.0 110.09 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 71.0 m -132.14 -177.11 4.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.333 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 10.9 p80 -144.41 -170.32 3.34 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.413 ' CE1' ' HA ' ' A' ' 57' ' ' ARG . 15.3 p90 -39.67 134.05 1.4 Allowed 'General case' 0 C--O 1.238 0.492 0 O-C-N 124.081 0.863 . . . . 0.0 111.073 175.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 73.31 95.76 0.07 Allowed 'General case' 0 N--CA 1.464 0.229 0 O-C-N 124.474 1.109 . . . . 0.0 109.426 -171.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.5 tp -60.31 128.6 37.51 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.443 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -78.84 -32.71 46.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.1 m 69.98 -51.25 0.64 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.281 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -56.38 -48.04 77.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.986 0.422 . . . . 0.0 111.574 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 33.8 t -64.25 -51.67 65.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.369 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.768 HD12 HD21 ' A' ' 84' ' ' LEU . 7.9 tp -68.97 -25.87 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.513 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.647 ' O ' ' O ' ' A' ' 85' ' ' SER . . . -64.35 -44.69 95.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.417 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.94 -24.49 65.19 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.241 0.544 . . . . 0.0 110.818 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -87.9 -57.05 3.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.163 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.768 HD21 HD12 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -71.94 -39.79 69.18 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.7 -170.506 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.647 ' O ' ' O ' ' A' ' 81' ' ' GLY . 32.6 t . . . . . 0 C--N 1.324 -0.524 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -174.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.762 -0.458 . . . . 74.44 109.762 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -93.24 99.77 12.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.052 0.454 . . . . 73.45 111.487 -174.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -104.44 63.27 0.73 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.661 -0.699 . . . . 72.22 109.435 173.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -95.03 -176.61 3.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 74.31 110.67 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -113.9 163.3 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.342 0.592 . . . . 75.14 111.394 -175.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -76.61 165.86 49.34 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 114.874 -1.057 . . . . 72.51 110.141 178.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.07 143.42 36.05 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.107 1.871 . . . . 72.33 111.839 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 1.001 ' NH1' ' O ' ' A' ' 85' ' ' SER . 10.8 ptp180 -97.73 171.39 8.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.761 -0.654 . . . . 73.42 109.751 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 84.4 tttt -135.79 152.78 51.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.048 0.452 . . . . 75.31 111.748 -174.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.645 HD13 ' CD1' ' A' ' 37' ' ' PHE . 95.4 mt -122.58 147.52 46.3 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.38 -0.827 . . . . 72.5 110.838 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.569 HG23 ' CG2' ' A' ' 64' ' ' VAL . 78.0 t -122.91 133.56 68.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.864 -0.607 . . . . 73.14 110.17 175.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.565 HG23 HD22 ' A' ' 61' ' ' LEU . 72.6 t -105.37 114.32 44.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 120.941 0.4 . . . . 71.43 110.304 175.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.11 117.88 29.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.937 -0.574 . . . . 75.32 110.074 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.446 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.28 163.91 26.66 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.271 -0.966 . . . . 74.15 112.56 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.454 ' CG ' HG13 ' A' ' 58' ' ' VAL . 3.3 ptm180 -150.29 114.31 5.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.252 -0.277 . . . . 71.4 110.252 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.68 17.93 4.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.715 -0.675 . . . . 71.04 112.549 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.58 64.92 0.36 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.071 -0.585 . . . . 74.21 111.76 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.16 -47.68 84.91 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.437 0.295 . . . . 63.41 111.478 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.9 t-160 -68.54 -47.25 67.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.519 -0.31 . . . . 72.21 110.546 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.12 -36.08 82.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.323 -0.399 . . . . 75.14 111.001 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.72 -47.8 82.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 63.3 110.14 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -56.88 -43.88 81.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.151 -0.477 . . . . 75.54 111.297 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.96 -48.18 79.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.882 -0.599 . . . . 74.33 110.989 -177.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.453 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 81.3 mtp -67.46 -38.69 84.83 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.872 -0.331 . . . . 72.21 111.153 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.46 -44.48 84.76 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.516 -0.179 . . . . 72.22 110.516 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.12 -43.34 82.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.891 0.377 . . . . 73.01 110.683 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -63.21 -43.33 98.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.051 177.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 24' ' ' MET . 92.7 mt -69.72 -34.36 73.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.932 -0.576 . . . . 74.12 111.112 -178.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.2 mmm-85 -60.67 -38.94 86.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.06 0.457 . . . . 74.45 110.576 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.1 t -70.13 -43.83 78.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.853 -0.612 . . . . 74.23 110.638 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -33.23 74.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.378 -0.374 . . . . 62.42 110.741 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -59.93 -23.92 63.92 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.746 0.308 . . . . 72.03 111.529 176.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -76.68 -17.69 58.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.103 0.478 . . . . 74.35 110.996 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -103.69 -43.14 5.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.699 -0.682 . . . . 74.31 110.423 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.528 ' HB3' HD11 ' A' ' 84' ' ' LEU . 20.0 m -142.94 119.88 11.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.217 -0.901 . . . . 72.43 109.452 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -78.22 131.77 37.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.345 . . . . 75.34 110.913 -177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.645 ' CD1' HD13 ' A' ' 10' ' ' LEU . 6.7 p90 -144.82 16.66 1.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.905 -0.588 . . . . 75.04 111.482 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 58.58 -175.32 0.09 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 73.32 110.974 -177.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.7 tp -151.58 110.71 3.9 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 122.001 -0.437 . . . . 64.12 110.692 172.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.524 ' HB3' HG21 ' A' ' 11' ' ' VAL . 9.4 tp10 -104.62 141.16 36.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.043 -0.526 . . . . 74.04 109.912 176.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.4 t -127.89 117.29 45.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.454 -0.573 . . . . 74.42 109.454 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.4 mt -128.65 110.62 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.429 . . . . 65.32 111.657 -176.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.4 m120 -68.54 107.41 2.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.896 -0.593 . . . . 64.52 110.007 171.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.5 pt -82.79 -7.52 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.09 -0.505 . . . . 72.35 111.089 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -59.13 -35.62 73.79 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.429 0.456 . . . . 64.33 111.031 -174.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -82.22 -12.38 80.85 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.574 -0.822 . . . . 74.05 112.873 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -103.9 110.14 22.16 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.073 0.464 . . . . 75.11 110.323 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -59.08 -44.36 91.87 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.48 -0.782 . . . . 71.32 111.12 -175.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -69.37 -34.96 75.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.578 -0.283 . . . . 74.04 111.442 -175.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.19 -34.71 66.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.88 0.372 . . . . 75.54 110.603 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.7 m -63.35 -31.19 72.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 74.23 110.702 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 52' ' ' ARG . 14.0 mmm-85 -57.67 -35.8 71.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.368 0.604 . . . . 74.23 110.823 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.8 mt -89.54 -50.14 6.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.498 -0.773 . . . . 64.42 112.401 -175.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.562 ' O ' HG11 ' A' ' 58' ' ' VAL . 20.0 m-85 -108.82 3.97 23.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.332 0.864 . . . . 73.3 113.332 -165.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -43.2 -56.75 3.29 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.237 0.828 . . . . 71.32 113.237 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -98.18 1.46 47.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.002 0.371 . . . . 74.3 112.002 -173.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.459 ' O ' HG23 ' A' ' 60' ' ' VAL . 96.5 mtt180 -132.96 55.12 1.91 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 75.51 108.897 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.767 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -80.37 -135.07 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 118.825 -0.607 . . . . 74.24 111.978 -172.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.767 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 39.5 Cg_exo -5.45 68.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.476 0 C-N-CA 122.73 2.287 . . . . 70.31 113.474 -139.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -91.09 127.21 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 CA-C-N 115.649 -0.705 . . . . 64.13 110.104 -171.143 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.565 HD22 HG23 ' A' ' 12' ' ' VAL . 2.7 tm? -93.0 107.3 19.11 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.675 -0.693 . . . . 74.35 109.577 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 83.6 t80 -98.71 138.22 36.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.077 -0.965 . . . . 71.52 111.305 -173.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.01 112.08 21.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.854 -0.612 . . . . 73.41 110.561 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.569 ' CG2' HG23 ' A' ' 11' ' ' VAL . 38.4 t -73.64 155.0 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.076 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 79.02 -49.0 0.43 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.913 0.885 . . . . 73.54 111.718 177.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -87.88 -20.45 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.734 0.302 . . . . 64.14 110.778 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.498 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 m-20 63.02 82.18 0.19 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.857 -0.611 . . . . 72.13 112.305 175.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? -167.17 139.91 3.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.641 -0.709 . . . . 64.13 110.19 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.34 126.2 30.56 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.153 -0.684 . . . . 72.45 109.153 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.458 ' HB3' HG13 ' A' ' 79' ' ' VAL . 83.6 mt -94.76 -79.21 0.43 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.397 0.618 . . . . 74.21 110.644 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.788 ' HG ' ' HB ' ' A' ' 79' ' ' VAL . 67.3 m -107.78 177.28 4.87 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.358 -0.837 . . . . 71.52 110.281 -175.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 6.6 p80 -131.78 -170.84 2.47 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.298 -0.63 . . . . 74.0 109.298 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.462 ' HD2' ' HD2' ' A' ' 74' ' ' PHE . 34.4 p90 -44.54 132.65 6.12 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 123.737 0.648 . . . . 74.52 110.204 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.462 ' HD2' ' HD2' ' A' ' 73' ' ' TYR . 93.1 m-85 70.78 103.35 0.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 O-C-N 124.026 0.829 . . . . 74.13 109.673 -171.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.5 tp -53.77 121.71 8.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.157 -0.929 . . . . 63.32 111.789 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -76.83 -22.78 53.09 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.993 -0.549 . . . . 72.3 110.264 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 71.27 -60.4 0.52 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.929 0.892 . . . . 73.52 112.923 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -57.33 -43.77 83.67 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.893 0.378 . . . . 73.22 111.427 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.788 ' HB ' ' HG ' ' A' ' 71' ' ' CYS . 83.5 t -66.61 -42.1 89.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.922 -0.581 . . . . 74.32 111.852 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.76 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -71.69 -36.25 58.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 120.085 -0.646 . . . . 74.45 110.244 177.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -58.9 -36.07 85.91 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.469 -0.872 . . . . 71.23 111.39 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.529 0.332 . . . . 63.13 111.265 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -88.08 -36.38 16.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.954 0.407 . . . . 74.23 111.306 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.76 HD23 HD11 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -81.52 14.31 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 72.42 111.914 -175.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 1.001 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 30.7 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.132 -0.485 . . . . 74.41 109.801 174.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 109.978 -0.379 . . . . 72.33 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -156.19 95.81 1.64 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.475 0.655 . . . . 75.14 111.186 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -86.79 76.88 9.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.55 0.69 . . . . 71.52 109.318 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -85.84 98.05 10.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.399 -0.819 . . . . 71.51 110.593 -175.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -90.86 132.4 35.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.739 -0.664 . . . . 72.21 110.073 177.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -137.77 148.28 60.27 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.717 -0.674 . . . . 75.14 110.33 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.84 -179.77 5.07 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.925 2.417 . . . . 72.11 111.722 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.419 ' HB3' ' OH ' ' A' ' 83' ' ' TYR . 25.9 mmt180 -97.07 -42.64 7.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.089 -0.505 . . . . 74.12 110.18 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.629 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.2 tmtp? 72.03 113.66 0.06 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.011 -0.995 . . . . 74.43 110.873 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 80' ' ' ILE . 44.7 mt -106.86 131.56 53.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.509 -0.769 . . . . 73.12 111.014 177.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.4 t -106.79 130.2 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 75.41 109.68 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.816 HG21 HD22 ' A' ' 61' ' ' LEU . 46.5 t -108.46 108.13 24.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 116.006 -0.543 . . . . 74.2 109.816 177.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.461 ' CB ' HG21 ' A' ' 60' ' ' VAL . 79.2 m-85 -76.22 118.25 18.75 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.965 -0.754 . . . . 72.41 108.965 175.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.87 -161.98 8.98 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.519 -0.848 . . . . 71.4 112.18 -176.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -162.65 -176.52 5.04 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.455 -0.572 . . . . 73.13 109.455 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.25 108.89 2.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.541 -0.3 . . . . 70.21 110.535 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 -144.93 16.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 121.087 -0.578 . . . . 73.22 112.067 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.8 m 70.69 95.76 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.056 0.542 . . . . 63.21 111.883 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.78 -39.59 81.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.633 -0.712 . . . . 72.31 109.897 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.531 HD22 ' OE2' ' A' ' 23' ' ' GLU . 64.6 mt -62.97 -30.94 71.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 74.52 111.794 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.89 -44.28 91.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 64.02 110.561 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -61.71 -43.01 99.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 60.05 110.279 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.531 ' OE2' HD22 ' A' ' 20' ' ' LEU . 39.0 mt-10 -66.0 -39.37 90.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.502 -0.772 . . . . 75.21 110.836 -178.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.408 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 11.6 mtt -61.25 -50.46 72.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 74.23 111.119 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.2 mt -57.21 -46.56 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.374 -0.376 . . . . 64.32 111.19 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.69 -32.58 73.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.914 0.388 . . . . 70.15 111.158 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -72.66 -45.52 58.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.765 -0.652 . . . . 54.44 110.875 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 24' ' ' MET . 96.9 mt -66.39 -32.37 73.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.927 -0.579 . . . . 75.33 111.233 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -56.73 -42.55 79.45 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.959 0.409 . . . . 74.11 110.91 176.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.14 -40.63 85.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.901 -0.591 . . . . 71.04 110.998 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.452 HD21 ' HA ' ' A' ' 31' ' ' LEU . 7.1 mt -70.06 -33.47 71.97 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.013 -0.275 . . . . 74.51 111.479 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -58.75 -21.15 54.73 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.853 0.359 . . . . 75.44 111.327 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -77.98 -15.48 58.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.423 . . . . 74.42 111.653 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.1 -43.91 4.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.542 0.687 . . . . 73.44 109.445 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.51 ' HB3' HD12 ' A' ' 84' ' ' LEU . 47.3 m -138.51 109.14 6.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.234 -0.894 . . . . 71.43 109.928 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -73.0 126.08 29.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.089 0.471 . . . . 74.33 110.963 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.629 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 4.7 p90 -136.04 18.75 3.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.022 -0.535 . . . . 74.31 111.368 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 59.92 175.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.532 0.682 . . . . 71.23 111.302 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.5 tp -151.26 109.79 3.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.009 -0.541 . . . . 74.12 110.606 173.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -121.22 117.79 27.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 63.33 109.868 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.55 115.26 48.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 109.764 -0.458 . . . . 75.45 109.764 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.2 mt -114.59 122.27 68.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.244 -0.435 . . . . 74.12 111.071 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.46 111.36 4.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.794 -0.639 . . . . 72.32 111.275 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.4 pt -81.0 -21.62 11.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.865 -0.421 . . . . 75.42 109.865 176.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -63.63 -18.95 64.47 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.901 -0.59 . . . . 74.34 111.476 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.87 9.14 59.94 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.691 -0.766 . . . . 62.22 112.253 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -133.09 113.11 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.743 0.306 . . . . 74.4 110.395 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -58.4 -42.6 87.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 64.23 111.248 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -60.5 -41.5 94.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.888 0.375 . . . . 74.31 110.678 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.488 HD22 HD13 ' A' ' 53' ' ' LEU . 77.1 mt -77.23 -32.09 55.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 64.34 111.019 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 72.5 m -67.86 -25.63 65.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.316 0.579 . . . . 74.33 110.362 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 53.1 mmt-85 -78.44 -35.12 47.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 70.25 110.143 177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.488 HD13 HD22 ' A' ' 50' ' ' LEU . 81.8 mt -70.76 -55.4 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 70.41 111.132 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -108.42 -67.68 0.96 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.006 -0.543 . . . . 71.41 112.065 -170.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 50.86 -87.38 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.984 0.803 . . . . 73.14 111.977 -170.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -89.38 21.86 3.16 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.398 0.618 . . . . 71.33 110.662 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -130.55 59.73 1.65 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.345 -0.843 . . . . 73.0 108.839 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.74 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -92.0 -127.1 0.0 OUTLIER Pre-proline 0 N--CA 1.431 -1.388 0 CA-C-O 117.823 -1.084 . . . . 75.13 109.735 -178.578 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.74 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 80.4 Cg_exo -12.96 71.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 122.504 2.136 . . . . 73.42 114.069 -143.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.461 HG21 ' CB ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -102.11 118.97 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.323 -0.853 . . . . 73.25 111.456 -170.326 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.816 HD22 HG21 ' A' ' 12' ' ' VAL . 50.8 mt -83.05 103.24 12.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.066 -0.515 . . . . 75.33 110.501 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -91.52 119.39 31.42 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.371 -0.831 . . . . 73.42 109.709 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.03 103.68 5.31 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.506 -0.77 . . . . 71.32 110.523 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.405 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 61.0 t -74.61 150.12 7.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 108.977 -0.749 . . . . 71.53 108.977 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.0 t30 67.04 21.94 10.09 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.839 0.828 . . . . 73.24 109.696 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.465 ' HG3' ' HE1' ' A' ' 83' ' ' TYR . 1.0 OUTLIER -152.56 -44.41 0.1 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.31 -0.859 . . . . 75.11 109.091 -178.587 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.7 t70 70.89 81.41 0.16 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.944 -1.025 . . . . 71.13 111.355 176.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -176.34 164.25 2.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.472 -0.786 . . . . 73.33 109.82 175.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -91.66 129.82 37.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.315 -0.402 . . . . 73.01 109.98 172.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.0 mt -84.29 -49.58 8.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.168 -0.678 . . . . 75.03 109.168 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 14.5 t -170.99 167.91 7.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.395 -0.965 . . . . 61.51 108.395 177.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.406 ' HB3' ' CG1' ' A' ' 60' ' ' VAL . 1.7 p-80 -143.96 147.2 33.6 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.152 -0.219 . . . . 65.32 111.204 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 74.97 -44.95 0.56 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 124.174 0.921 . . . . 74.23 111.967 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -125.21 163.74 21.81 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.339 -0.615 . . . . 71.52 109.339 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.7 tp -113.64 101.2 9.1 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.368 -0.378 . . . . 71.14 111.566 -168.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -80.98 93.01 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.738 -0.467 . . . . 71.55 109.738 172.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.48 ' HA ' HG21 ' A' ' 80' ' ' ILE . 14.1 m -56.25 -34.42 66.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.84 -0.618 . . . . 75.33 110.574 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -58.82 -40.59 84.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.545 -0.752 . . . . 73.41 111.134 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 91.2 t -76.8 -49.26 24.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.131 -0.486 . . . . 73.41 111.716 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.484 HD12 HD22 ' A' ' 84' ' ' LEU . 7.2 tp -63.36 -35.24 71.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 120.737 -0.385 . . . . 74.51 110.694 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.25 -36.19 91.4 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.89 -0.671 . . . . 63.35 111.708 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.16 75.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 73.33 110.751 177.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.465 ' HE1' ' HG3' ' A' ' 66' ' ' GLU . 40.3 t80 -87.18 -50.09 6.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.837 -0.619 . . . . 74.1 111.839 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.51 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -63.58 -45.56 89.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.289 -0.414 . . . . 74.32 111.503 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 C--N 1.32 -0.715 0 CA-C-N 116.325 -0.398 . . . . 75.13 110.762 -177.371 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 120.934 0.397 . . . . 74.35 110.789 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -148.29 105.13 3.59 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.341 -0.615 . . . . 73.23 109.341 172.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -80.38 -31.01 37.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.154 -0.475 . . . . 75.05 110.079 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 55.51 85.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.054 -0.976 . . . . 71.41 111.472 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.8 m -102.28 94.53 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.187 0.994 . . . . 71.51 110.952 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -130.76 123.09 19.92 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-N 114.564 -1.198 . . . . 75.14 109.477 -178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -89.37 -170.75 0.47 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.285 2.657 . . . . 54.42 112.889 -172.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.433 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 22.7 mmt180 -103.99 164.87 11.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.634 -0.712 . . . . 70.3 109.576 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.1 tmtp? -141.23 129.52 22.32 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.7 -0.481 . . . . 72.44 109.7 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.496 HD12 ' CD1' ' A' ' 80' ' ' ILE . 57.9 mt -113.84 139.85 48.82 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.079 -0.51 . . . . 71.43 111.598 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.532 HG23 ' CG2' ' A' ' 64' ' ' VAL . 53.3 t -112.26 129.57 67.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.63 -0.714 . . . . 74.43 109.336 170.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.635 HG21 HD21 ' A' ' 61' ' ' LEU . 39.2 t -99.11 114.25 36.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.752 -0.462 . . . . 73.24 109.752 174.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -89.62 126.01 35.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.928 -0.578 . . . . 74.42 110.464 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.05 -163.34 12.93 Favored Glycine 0 N--CA 1.443 -0.862 0 C-N-CA 120.737 -0.744 . . . . 63.44 111.714 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -149.34 160.54 43.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.195 -0.298 . . . . 75.34 110.195 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -62.45 110.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.237 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.4 -19.6 4.53 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.531 -0.842 . . . . 53.04 112.463 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.7 m -74.39 85.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.894 0.378 . . . . 73.53 110.539 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -70.86 -30.82 67.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 73.2 110.354 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -60.31 -32.12 70.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.775 -0.648 . . . . 72.51 109.779 176.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 53.9 t -67.76 -38.7 83.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 63.14 110.265 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' ILE . 50.6 mt-10 -68.0 -32.59 73.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.639 -0.71 . . . . 64.42 110.51 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.89 -39.33 94.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.933 -0.576 . . . . 73.43 110.079 174.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.672 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 78.6 mtp -69.33 -27.29 65.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.562 -0.744 . . . . 74.11 110.936 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 22' ' ' GLU . 74.0 mt -57.01 -43.41 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.462 -0.335 . . . . 73.53 110.17 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.46 97.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 72.23 110.665 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.9 m -60.18 -47.98 83.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.73 -0.668 . . . . 73.54 110.668 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 88.5 mt -62.37 -43.13 99.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.795 -0.639 . . . . 73.43 111.009 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -55.48 -43.48 75.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 74.23 111.575 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.0 t -65.46 -40.96 89.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.495 -0.321 . . . . 74.54 110.685 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.428 HD21 ' HA ' ' A' ' 31' ' ' LEU . 2.2 mt -66.76 -35.14 79.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.637 -0.256 . . . . 71.11 111.014 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 98.9 mt-30 -60.58 -21.38 62.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 63.01 111.503 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -78.05 -13.43 59.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.3 110.799 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -42.23 5.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.96 -0.563 . . . . 70.32 109.985 175.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.509 ' HB3' HD12 ' A' ' 84' ' ' LEU . 31.8 m -141.02 121.03 13.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.448 -0.796 . . . . 74.01 109.869 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -85.45 125.15 32.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.057 0.456 . . . . 74.12 111.199 -175.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HB3' HD13 ' A' ' 84' ' ' LEU . 10.5 p90 -133.46 17.07 4.01 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.723 -0.671 . . . . 74.33 111.291 178.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 58.67 -178.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.418 0.627 . . . . 74.12 111.313 -176.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.8 tp -151.25 109.93 3.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.033 -0.531 . . . . 65.04 110.456 173.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -108.76 143.82 37.39 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.512 -0.551 . . . . 74.0 109.512 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.89 108.07 17.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.587 -0.523 . . . . 70.53 109.587 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.405 HD12 HG11 ' A' ' 11' ' ' VAL . 59.5 mt -118.78 118.45 57.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.082 0.468 . . . . 74.44 111.079 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -78.07 115.74 18.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.735 -0.666 . . . . 75.1 109.818 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.57 HG22 ' HB3' ' A' ' 50' ' ' LEU . 26.7 pt -71.74 -34.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.111 -0.495 . . . . 74.01 111.458 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.88 98.1 0.26 Allowed 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.37 0.605 . . . . 65.42 110.768 178.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 146.72 -37.79 1.17 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.053 -1.219 . . . . 74.01 110.053 -176.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -97.65 109.02 21.86 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.527 -0.916 . . . . 74.41 108.527 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -50.62 -34.96 28.17 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 123.878 0.736 . . . . 75.32 111.383 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.71 -49.97 19.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.396 -0.366 . . . . 75.21 110.756 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.57 ' HB3' HG22 ' A' ' 44' ' ' ILE . 32.9 mt -66.42 -34.45 77.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.795 -0.184 . . . . 74.43 111.36 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.1 m -57.78 -56.41 22.27 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.892 -0.323 . . . . 61.23 110.163 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HD3' ' HA ' ' A' ' 52' ' ' ARG . 35.0 mmt180 -63.78 -31.55 72.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.594 0.235 . . . . 73.52 111.54 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.0 mt -69.89 -47.15 63.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.4 0.518 . . . . 74.34 112.4 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 58' ' ' VAL . 96.9 m-85 -117.4 -9.56 10.87 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.33 1.233 . . . . 73.55 114.33 -167.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -76.84 82.97 3.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 119.078 0.854 . . . . 74.32 109.658 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.559 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 16.2 t70 -154.34 -59.42 0.12 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.633 -1.167 . . . . 74.51 109.075 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 56' ' ' ASP . 46.7 mtm180 -157.91 90.33 1.06 Allowed 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.28 -1.748 . . . . 75.23 106.28 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.466 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.12 -107.06 0.0 OUTLIER Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 113.473 0.916 . . . . 71.54 113.473 -161.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.466 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 96.4 Cg_exo -9.62 72.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.695 0 C-N-CA 122.709 2.272 . . . . 75.33 113.873 -140.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -98.28 135.23 33.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.322 -0.854 . . . . 75.23 110.968 -168.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.635 HD21 HG21 ' A' ' 12' ' ' VAL . 34.9 mt -93.52 107.83 19.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 72.13 110.796 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -92.45 123.6 35.87 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.636 -0.711 . . . . 73.23 110.519 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.8 107.14 7.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.803 -0.635 . . . . 74.44 109.553 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.532 ' CG2' HG23 ' A' ' 11' ' ' VAL . 92.3 t -69.78 -31.33 48.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.924 0.392 . . . . 74.02 111.661 -174.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -81.85 -44.73 16.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.139 0.495 . . . . 75.44 110.67 -178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.424 ' CG ' ' HE3' ' A' ' 68' ' ' LYS . 3.5 tp10 -85.55 -20.94 28.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.15 111.138 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 62.23 74.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.664 -0.698 . . . . 75.23 110.56 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HE3' ' CG ' ' A' ' 66' ' ' GLU . 19.6 ptpt -172.55 158.08 4.09 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.656 -0.702 . . . . 74.42 110.061 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -84.4 118.79 24.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.0 -0.371 . . . . 72.1 110.0 173.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 82.8 mt -88.01 -68.53 0.75 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.602 0.715 . . . . 65.51 110.788 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 85.6 m -119.21 170.74 8.82 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.697 -1.138 . . . . 65.13 110.41 -173.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -132.65 -172.23 2.86 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.704 -0.68 . . . . 74.01 109.645 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.672 ' HA ' ' SD ' ' A' ' 24' ' ' MET . 21.6 p90 -52.45 138.31 27.7 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.71 -0.478 . . . . 74.01 109.71 175.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.417 ' HD1' ' CD2' ' A' ' 73' ' ' TYR . 82.4 m-85 70.67 98.59 0.06 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.957 0.786 . . . . 75.23 108.978 -167.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 tp -52.39 119.93 4.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.684 -1.144 . . . . 61.42 112.454 -170.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.21 -31.46 72.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.919 -0.582 . . . . 74.34 109.712 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.2 m 72.91 -54.63 0.69 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.118 -0.946 . . . . 73.4 112.834 172.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -74.63 -48.75 24.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.524 0.202 . . . . 72.44 111.504 -175.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 15.4 t -56.32 -49.35 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 112.412 0.523 . . . . 71.12 112.412 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.632 HD13 HD21 ' A' ' 84' ' ' LEU . 5.7 tp -64.6 -30.93 51.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 C-N-CA 120.302 -0.559 . . . . 72.34 110.507 177.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.82 -37.04 93.66 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.83 -0.7 . . . . 73.55 112.021 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.68 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.39 0.614 . . . . 71.21 111.019 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -84.35 -36.18 22.69 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 70.43 110.798 -179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.632 HD21 HD13 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -87.84 13.54 10.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.807 -0.633 . . . . 74.5 111.759 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.443 -0.344 . . . . 74.12 110.129 175.861 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.4 mtm . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 109.695 -0.483 . . . . 75.1 109.695 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -85.31 103.29 14.1 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.835 0.35 . . . . 70.15 110.585 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -113.33 -52.03 2.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.26 -0.427 . . . . 72.34 110.808 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.24 145.19 41.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.031 0.443 . . . . 73.14 110.896 -177.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.8 m -111.15 -172.49 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.639 -0.709 . . . . 74.51 111.243 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -87.44 159.22 50.59 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.948 -0.569 . . . . 72.33 110.535 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -80.96 166.54 18.87 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.467 2.112 . . . . 74.55 112.544 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -95.22 171.68 8.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.968 -0.56 . . . . 72.02 109.882 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 45.8 mtpt -126.56 146.99 49.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.834 0.35 . . . . 75.41 110.829 175.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.487 HD13 HD11 ' A' ' 80' ' ' ILE . 84.1 mt -120.42 128.24 53.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.814 -0.63 . . . . 75.22 110.1 174.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.514 HG22 ' HB3' ' A' ' 40' ' ' GLU . 55.4 t -108.5 127.41 64.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.896 -0.593 . . . . 62.22 110.305 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.695 HG23 HD22 ' A' ' 61' ' ' LEU . 86.0 t -98.94 108.2 21.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.772 -0.649 . . . . 74.43 109.276 174.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.552 ' CB ' HG23 ' A' ' 60' ' ' VAL . 19.0 m-85 -77.93 107.76 10.69 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.576 -0.45 . . . . 64.25 109.886 176.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -130.72 -145.51 5.71 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.946 -0.861 . . . . 70.22 110.946 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -174.78 110.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.878 0.339 . . . . 75.41 111.241 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 65.06 -87.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.663 -0.699 . . . . 75.32 111.727 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.46 134.52 5.21 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 121.03 -0.605 . . . . 74.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.565 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 44.1 t -153.29 141.29 20.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.918 -0.401 . . . . 74.43 109.918 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -60.22 -34.64 73.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 72.04 110.922 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.561 ' HG ' ' HD1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -73.72 -32.95 64.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.535 . . . . 71.11 111.243 -177.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 70.7 m -64.28 -42.19 96.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.472 -0.331 . . . . 70.1 110.455 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -54.4 -38.25 65.98 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.222 0.534 . . . . 71.14 110.437 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -74.75 -48.38 25.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.665 -0.698 . . . . 71.44 111.345 -176.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 87.3 mtp -67.13 -42.95 83.57 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.112 -0.235 . . . . 75.01 111.282 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.8 mt -58.74 -48.28 86.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.401 0.143 . . . . 64.13 110.926 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.952 0.406 . . . . 63.43 110.892 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 m -62.91 -43.89 97.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.795 -0.639 . . . . 64.53 111.074 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 92.9 mt -69.03 -35.25 76.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.31 -0.404 . . . . 74.23 111.373 -178.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.6 mmm180 -57.77 -40.95 80.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.858 0.361 . . . . 62.0 110.864 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.5 t -67.31 -40.12 84.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 74.1 110.867 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.33 -32.06 72.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.69 -0.232 . . . . 75.43 111.23 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 95.3 mt-30 -57.65 -23.01 48.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 72.33 111.339 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -76.58 -19.18 58.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.143 -0.481 . . . . 74.33 111.177 -177.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -105.46 -40.25 5.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.124 0.488 . . . . 75.03 110.545 176.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.531 ' HB3' HD11 ' A' ' 84' ' ' LEU . 19.6 m -140.92 120.38 13.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.915 -0.584 . . . . 73.43 109.756 -178.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.7 t-105 -83.81 123.98 30.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.116 0.484 . . . . 71.14 111.159 -176.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.56 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 5.6 p90 -134.88 19.07 3.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.487 -0.779 . . . . 73.23 110.519 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 59.01 -178.23 0.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.923 -0.58 . . . . 75.12 110.302 -176.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.6 tp -151.95 108.71 3.49 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.619 -0.512 . . . . 75.41 109.619 170.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' HB3' HG22 ' A' ' 11' ' ' VAL . 19.4 tt0 -120.28 117.9 29.03 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.569 -0.741 . . . . 71.15 109.473 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.06 108.6 25.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 73.54 109.534 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 13' ' ' TYR . 70.3 mt -110.12 118.01 56.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.92 -0.582 . . . . 72.44 110.001 -177.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 87.4 m-20 -70.19 138.08 51.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.953 -0.567 . . . . 70.13 110.51 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.8 pt -65.89 -25.74 36.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.524 -0.917 . . . . 74.34 108.524 169.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 43' ' ' ASN . 10.6 t70 -57.11 112.01 1.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.589 -1.187 . . . . 63.01 109.548 170.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 120.42 -25.91 7.17 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.049 -0.82 . . . . 62.21 111.049 -174.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -118.57 106.86 13.07 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.595 -0.52 . . . . 71.21 109.595 175.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.48 -33.79 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.216 -0.447 . . . . 74.32 111.176 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -69.17 -35.57 76.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.453 -0.339 . . . . 74.24 110.516 -176.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.467 ' HB3' HG21 ' A' ' 44' ' ' ILE . 71.5 mt -73.36 -44.28 59.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 75.01 110.887 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.531 ' HA ' HD12 ' A' ' 44' ' ' ILE . 38.4 m -65.97 -25.24 67.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.037 0.446 . . . . 71.34 110.921 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -38.54 89.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.321 0.581 . . . . 70.45 110.099 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 75.8 mt -90.43 -52.89 4.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.383 -0.826 . . . . 73.2 111.463 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -102.74 21.0 16.23 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.758 0.651 . . . . 72.31 112.758 -167.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -50.81 -44.24 59.03 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.774 0.321 . . . . 75.21 111.191 176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -124.27 24.96 7.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.218 1.009 . . . . 74.4 109.271 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -136.32 36.97 2.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.419 -0.956 . . . . 72.33 108.419 -178.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.567 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -83.16 -108.09 0.0 OUTLIER Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.37 -0.824 . . . . 50.13 110.56 -173.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.567 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 31.0 Cg_exo -15.01 68.01 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.481 0 C-N-CA 122.622 2.214 . . . . 74.54 114.124 -144.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.703 HG13 ' HB3' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -98.99 115.78 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 114.933 -1.03 . . . . 75.11 110.497 -172.323 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.695 HD22 HG23 ' A' ' 12' ' ' VAL . 2.4 tm? -86.64 105.13 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.584 -0.734 . . . . 72.23 109.528 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -92.28 129.46 38.22 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.959 -1.019 . . . . 75.43 110.58 -176.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -84.79 105.74 15.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.521 -0.763 . . . . 73.13 110.683 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.449 HG22 HG21 ' A' ' 11' ' ' VAL . 24.9 t -79.35 84.09 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 74.04 110.586 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 176.23 -54.46 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.992 -1.004 . . . . 53.2 109.248 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -98.0 -12.82 21.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.067 -0.969 . . . . 72.13 111.007 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 61.8 78.1 0.3 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.89 -0.595 . . . . 70.25 109.799 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.58 163.92 6.72 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.515 -0.766 . . . . 75.42 110.213 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -84.58 142.95 29.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.341 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.6 mt -99.88 -32.71 10.86 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.506 -0.553 . . . . 71.21 109.506 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.8 t -173.7 151.74 1.92 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.176 -0.92 . . . . 74.33 109.244 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.703 ' HB3' HG13 ' A' ' 60' ' ' VAL . 2.6 p-80 -135.24 129.96 34.47 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.716 -0.476 . . . . 75.32 109.716 173.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.561 ' HD1' ' HG ' ' A' ' 20' ' ' LEU . 96.8 m-85 66.71 122.15 0.02 OUTLIER 'General case' 0 C--O 1.235 0.341 0 O-C-N 124.239 0.962 . . . . 75.25 110.728 -170.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.4 ' H ' ' CD1' ' A' ' 20' ' ' LEU . 84.5 m-85 65.67 -160.85 0.27 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.077 -1.419 . . . . 74.13 109.603 -176.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.5 tp -136.98 117.34 13.64 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 120.088 -0.645 . . . . 71.45 111.761 -172.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -86.86 87.65 7.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.135 -0.484 . . . . 65.11 109.741 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 m -59.33 -32.3 69.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.809 -0.632 . . . . 74.42 110.753 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -59.16 -43.39 92.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.837 -0.62 . . . . 74.51 111.169 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.4 t -75.33 -46.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 72.53 111.562 -176.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.764 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.99 -30.91 48.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.257 -0.577 . . . . 73.25 110.323 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.23 -29.52 75.51 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.561 -0.828 . . . . 63.33 111.524 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.98 -26.54 36.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.089 0.471 . . . . 73.41 110.508 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -87.46 -52.55 5.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 74.51 112.157 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.764 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.231 -0.44 . . . . 63.43 111.461 -170.169 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 75.32 110.188 177.04 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.53 -0.544 . . . . 75.21 109.53 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -125.37 101.36 6.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 110.159 -0.312 . . . . 71.32 110.159 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -88.36 102.31 14.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.138 0.494 . . . . 72.33 110.646 -178.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -84.57 100.82 11.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 75.41 110.555 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.0 m -129.83 140.77 48.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.847 -0.615 . . . . 74.1 109.699 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -140.56 143.34 32.27 Favored Pre-proline 0 C--N 1.316 -0.849 0 CA-C-N 116.012 -0.54 . . . . 75.41 109.682 -177.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.8 122.81 5.55 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.401 2.067 . . . . 74.32 111.569 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.35 105.08 13.96 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 72.35 110.318 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 10' ' ' LEU . 1.9 tmtp? -71.47 146.33 48.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.063 -0.971 . . . . 74.04 110.247 -173.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.64 HD11 ' CD1' ' A' ' 37' ' ' PHE . 98.5 mt -124.48 136.85 54.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.073 0.464 . . . . 74.34 111.347 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.69 HG22 HG21 ' A' ' 64' ' ' VAL . 39.3 t -114.48 135.72 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.89 -0.595 . . . . 75.32 110.17 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.679 HG23 HD21 ' A' ' 61' ' ' LEU . 98.5 t -107.54 106.84 21.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.565 -0.531 . . . . 74.42 109.565 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.443 ' CB ' HG21 ' A' ' 60' ' ' VAL . 89.7 m-85 -76.99 122.98 25.67 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.764 -0.828 . . . . 74.42 108.764 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -157.51 -169.26 21.06 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 119.503 -1.332 . . . . 64.53 112.922 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -154.6 144.58 21.77 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.848 -0.797 . . . . 73.22 108.848 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -75.83 87.92 2.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.046 0.451 . . . . 75.33 110.037 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.08 32.1 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.551 -0.749 . . . . 60.25 111.511 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 p -170.58 138.99 1.53 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.69 -0.485 . . . . 74.31 109.69 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -70.68 -29.89 66.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 74.5 112.127 -172.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.441 HD12 ' CD1' ' A' ' 73' ' ' TYR . 26.4 mt -55.78 -30.4 61.23 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.489 0.551 . . . . 72.12 112.489 -175.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.461 ' O ' HG13 ' A' ' 25' ' ' ILE . 76.1 m -54.5 -50.5 67.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.327 . . . . 75.01 110.863 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.75 -35.59 81.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.115 -0.493 . . . . 65.41 110.834 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -68.76 -44.1 74.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.669 -0.696 . . . . 71.53 111.309 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.6 mtp -65.65 -37.53 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.925 -0.31 . . . . 75.31 111.157 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.0 mt -57.71 -52.38 58.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 110.143 -0.317 . . . . 71.13 110.143 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.44 89.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 64.24 110.879 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.8 m -59.15 -42.87 91.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.92 -0.582 . . . . 73.04 111.106 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.2 mt -68.45 -42.53 78.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 73.14 111.046 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -60.84 -26.44 67.35 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.97 0.359 . . . . 74.11 111.97 -175.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.79 -44.83 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.654 0.264 . . . . 75.52 110.602 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.87 -26.01 53.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.343 0.592 . . . . 74.13 109.82 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.403 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . 41.4 tt0 -60.98 -20.54 62.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.4 -0.818 . . . . 72.12 110.366 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -71.95 -16.83 62.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.828 -0.624 . . . . 75.04 111.514 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.35 -39.02 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.49 -0.323 . . . . 73.31 111.153 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.2 m -126.97 135.98 51.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.505 -0.316 . . . . 64.0 111.056 -174.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -84.13 110.93 18.88 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.224 -0.443 . . . . 73.0 110.478 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.874 ' HB3' HD12 ' A' ' 84' ' ' LEU . 32.4 p90 -132.57 6.18 4.06 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.93 -0.577 . . . . 72.04 110.744 176.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 59.77 -177.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.675 . . . . 64.32 111.546 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -149.19 120.02 7.59 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.994 -0.548 . . . . 63.05 110.017 175.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.527 ' HB3' HG23 ' A' ' 11' ' ' VAL . 23.3 tt0 -131.29 118.03 19.78 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.822 -0.436 . . . . 72.1 109.822 177.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -103.9 114.24 42.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 109.543 -0.54 . . . . 64.2 109.543 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 62.6 mt -112.62 116.89 53.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.256 0.55 . . . . 74.43 111.04 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -71.75 107.45 4.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 71.1 110.582 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 29.7 pt -76.34 -10.73 13.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.286 0.565 . . . . 75.34 109.62 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -46.81 -39.2 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.421 -1.263 . . . . 74.24 112.651 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.5 20.99 48.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.526 -0.845 . . . . 75.25 112.9 -176.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -137.26 110.36 7.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.882 0.341 . . . . 71.5 110.564 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -59.02 -33.78 71.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.334 -0.394 . . . . 63.35 111.807 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 66.2 m170 -66.21 -52.19 50.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 73.45 110.404 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.35 -38.97 88.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.87 -0.604 . . . . 73.43 110.958 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 94.9 m -62.05 -40.97 97.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.872 0.367 . . . . 74.44 111.243 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 70.1 mtp85 -75.53 -31.98 60.3 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 122.077 -0.39 . . . . 74.43 110.576 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -64.12 -51.43 64.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 73.03 110.978 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -109.61 -72.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.067 -0.515 . . . . 73.12 111.596 -173.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 51.02 -81.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.691 0.797 . . . . 64.21 111.725 -169.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -91.23 8.6 35.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.686 0.755 . . . . 71.22 110.104 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.11 46.89 1.1 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.203 -0.666 . . . . 74.42 109.203 169.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.796 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -81.86 -142.24 0.0 OUTLIER Pre-proline 0 N--CA 1.447 -0.6 0 CA-C-O 118.578 -0.725 . . . . 72.25 110.653 -178.781 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.796 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 82.7 Cg_exo -8.01 71.38 0.0 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.885 0 C-N-CA 122.663 2.242 . . . . 73.13 113.885 -139.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.443 HG21 ' CB ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.77 113.48 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.453 -0.794 . . . . 61.32 110.136 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.679 HD21 HG23 ' A' ' 12' ' ' VAL . 2.5 tm? -83.37 106.75 15.38 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.765 -0.652 . . . . 74.2 109.355 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -100.57 134.4 43.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.82 -1.082 . . . . 75.44 110.797 -175.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.507 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -84.91 106.19 16.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.841 -0.618 . . . . 75.41 110.943 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.69 HG21 HG22 ' A' ' 11' ' ' VAL . 49.1 t -86.31 91.93 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.937 0.399 . . . . 72.11 111.067 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 168.97 -57.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.666 -1.152 . . . . 75.51 108.21 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -91.21 -18.87 23.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.549 -0.75 . . . . 73.24 110.499 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.1 t70 68.05 87.02 0.13 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.689 -0.687 . . . . 71.24 110.002 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.507 ' HG3' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -167.37 165.53 14.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.312 -0.858 . . . . 75.1 109.467 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -108.99 137.8 46.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.892 -0.41 . . . . 74.03 109.892 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.462 HD13 HD11 ' A' ' 61' ' ' LEU . 18.9 mt -96.79 -70.47 0.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.017 0.437 . . . . 74.0 110.869 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 21.4 p -143.91 160.63 40.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 63.14 110.189 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.528 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.8 p-80 -139.54 144.47 37.88 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.159 -0.216 . . . . 74.41 110.999 179.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.441 ' CD1' HD12 ' A' ' 20' ' ' LEU . 6.6 m-85 74.54 -43.79 0.54 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.831 0.852 . . . . 75.33 112.81 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -135.56 137.0 41.59 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.202 -0.666 . . . . 72.01 109.202 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 17.8 tp -89.71 110.71 21.58 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.049 0.452 . . . . 62.32 110.525 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -64.97 -28.41 69.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.805 -0.634 . . . . 72.35 111.087 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.0 m 75.77 -40.99 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.804 -0.635 . . . . 72.31 112.143 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -76.6 -45.97 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.071 -0.393 . . . . 72.42 110.455 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.3 t -55.31 -49.83 69.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.171 -0.468 . . . . 72.33 111.68 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.497 HD12 HD12 ' A' ' 10' ' ' LEU . 7.2 tp -66.83 -34.75 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 64.32 110.397 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.24 -22.84 77.57 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.879 -0.677 . . . . 63.52 111.972 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.16 -32.76 56.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.166 0.507 . . . . 73.34 110.173 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.466 ' CZ ' ' HB2' ' A' ' 63' ' ' ALA . 85.2 t80 -87.09 -38.97 16.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.637 -0.71 . . . . 75.54 111.804 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.874 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -79.17 4.02 16.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.637 0.606 . . . . 74.41 112.637 -171.453 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.606 -0.516 . . . . 74.01 109.606 173.293 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.416 ' HB3' ' HB3' ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 108.81 -0.811 . . . . 75.22 108.81 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -53.58 -51.61 62.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.861 0.319 . . . . 64.12 111.861 -176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -122.07 70.12 0.96 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.396 0.617 . . . . 52.44 110.643 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.416 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 15.9 pt20 -90.79 160.57 15.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.74 -0.664 . . . . 73.3 109.588 176.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.8 m -121.52 155.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 72.13 112.497 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -145.83 160.4 43.96 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 114.673 -1.148 . . . . 70.21 108.609 177.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -76.66 158.93 35.57 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.02 1.814 . . . . 64.11 111.827 -179.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.696 ' NH2' ' O ' ' A' ' 85' ' ' SER . 44.9 mtt180 -81.21 -21.64 39.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.418 -0.356 . . . . 73.42 111.436 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.9 tmtp? 64.34 108.52 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.933 0.771 . . . . 71.43 112.828 170.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.512 HD12 ' CD1' ' A' ' 37' ' ' PHE . 32.0 mt -105.43 133.01 50.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.618 -0.719 . . . . 61.23 110.811 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.546 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.6 t -109.85 131.69 60.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.687 -0.688 . . . . 74.43 109.84 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.513 HG23 ' CD2' ' A' ' 61' ' ' LEU . 62.3 t -99.31 109.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.829 -0.434 . . . . 75.43 109.829 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.48 ' CB ' HG22 ' A' ' 60' ' ' VAL . 12.9 m-85 -84.33 120.33 26.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.138 -0.483 . . . . 71.52 110.124 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -138.87 170.5 23.99 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.157 -0.777 . . . . 63.52 111.157 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -135.72 123.66 22.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.12 0.46 . . . . 75.23 110.813 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 61.27 -81.53 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.262 0.976 . . . . 73.43 112.454 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.82 139.36 6.01 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.673 -0.775 . . . . 51.11 112.203 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.2 m -148.84 115.71 6.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.1 -0.333 . . . . 75.14 110.1 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -56.48 -46.84 80.25 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.983 0.421 . . . . 63.11 111.098 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' H ' ' A' ' 74' ' ' PHE . 1.9 tm? -63.98 -32.15 73.59 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.767 -0.651 . . . . 72.31 110.707 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.33 -38.68 85.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.535 -0.302 . . . . 70.22 110.557 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.21 -39.92 73.24 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.493 0.663 . . . . 75.4 110.22 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -69.89 -34.18 73.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.085 -0.961 . . . . 54.22 110.843 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.483 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 73.3 mtp -68.0 -42.18 81.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 74.13 109.982 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.7 mt -55.83 -46.12 79.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.748 -0.66 . . . . 73.21 110.728 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.01 98.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.509 . . . . 73.34 110.91 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 m -60.52 -39.09 86.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.291 0.567 . . . . 73.51 110.717 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.53 HD12 HD22 ' A' ' 61' ' ' LEU . 84.3 mt -71.24 -33.8 70.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.999 -0.546 . . . . 63.3 111.684 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -62.14 -40.73 96.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.362 . . . . 72.42 110.213 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 63.0 t -66.76 -43.65 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 72.13 110.858 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 31' ' ' LEU . 7.0 mt -63.03 -33.66 75.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.69 -0.232 . . . . 73.24 111.27 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.413 ' HA ' ' O ' ' A' ' 35' ' ' SER . 47.5 mt-30 -58.94 -25.27 63.35 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.876 0.324 . . . . 63.23 111.876 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -75.37 -19.39 59.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.077 0.465 . . . . 74.54 110.734 -179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -101.33 -44.68 5.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 74.4 109.689 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.521 ' HB3' HD11 ' A' ' 84' ' ' LEU . 13.5 m -139.22 120.35 14.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 64.23 109.582 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -83.61 124.01 30.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.391 0.615 . . . . 74.22 111.226 -174.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.512 ' CD1' HD12 ' A' ' 10' ' ' LEU . 4.4 p90 -135.45 13.95 3.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.864 -0.607 . . . . 75.41 111.369 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 60.44 174.45 0.1 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.465 0.65 . . . . 74.21 111.584 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.1 tp -151.32 112.76 4.38 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.133 -0.485 . . . . 74.45 110.726 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.529 ' HB3' HG22 ' A' ' 11' ' ' VAL . 28.1 tt0 -124.77 118.76 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -99.94 120.52 49.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.865 -0.421 . . . . 73.32 109.865 -177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 71.2 mt -125.82 121.13 59.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.941 0.401 . . . . 73.12 111.178 -176.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 9.3 m120 -66.62 125.7 26.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.742 -0.663 . . . . 73.15 111.162 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 50' ' ' LEU . 22.3 pt -88.12 -23.24 6.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.459 -0.337 . . . . 74.33 110.268 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -59.92 117.18 4.73 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.383 0.611 . . . . 64.43 110.429 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.24 -31.02 6.95 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.482 -0.781 . . . . 70.14 111.465 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -92.79 113.34 25.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.233 -0.654 . . . . 75.12 109.233 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -38.13 89.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.696 -0.229 . . . . 74.13 111.553 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -60.6 -51.51 69.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.28 0.562 . . . . 74.04 110.4 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.424 HD11 HG22 ' A' ' 44' ' ' ILE . 92.6 mt -67.58 -37.56 82.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.668 -0.697 . . . . 75.35 111.253 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.8 m -66.57 -43.46 84.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 75.54 110.842 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -67.28 -37.39 83.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.819 0.342 . . . . 75.4 110.293 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.2 -55.92 13.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.047 -0.524 . . . . 74.44 111.46 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.86 -66.07 0.97 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.394 -0.366 . . . . 74.22 111.529 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.7 t30 51.92 -83.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.111 0.782 . . . . 72.44 113.111 -175.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -85.44 -16.41 39.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.983 -0.553 . . . . 72.34 111.676 -170.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.62 78.0 1.48 Allowed 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.347 -1.353 . . . . 71.13 107.347 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.518 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.28 -97.54 0.0 OUTLIER Pre-proline 0 N--CA 1.423 -1.794 0 CA-C-O 118.163 -0.922 . . . . 70.23 110.676 -175.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.518 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 85.3 Cg_exo -21.29 75.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.821 2.347 . . . . 75.25 114.154 -149.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -107.23 122.89 62.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.267 -0.879 . . . . 74.34 110.798 -170.764 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.53 HD22 HD12 ' A' ' 28' ' ' LEU . 48.1 mt -85.01 109.56 18.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.084 0.469 . . . . 72.42 110.769 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.546 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 88.1 t80 -92.46 124.11 36.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.448 -0.796 . . . . 75.34 110.691 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.83 109.17 16.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.744 . . . . 71.04 109.719 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.474 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 57.8 t -73.21 -20.53 18.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.289 -0.414 . . . . 51.42 111.794 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -51.78 18.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.951 0.352 . . . . 64.42 111.951 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -100.95 -5.19 26.27 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.823 0.344 . . . . 74.03 111.464 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 63.61 78.87 0.27 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.495 0.664 . . . . 65.25 111.344 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.98 177.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.111 -0.95 . . . . 74.51 108.82 175.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.52 156.38 17.32 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 120.905 0.383 . . . . 72.32 110.694 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -111.1 -76.32 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.621 0.724 . . . . 74.04 110.403 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 41.5 t -115.7 142.92 46.1 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.574 -1.194 . . . . 72.43 109.737 -175.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.552 ' HB3' HG13 ' A' ' 60' ' ' VAL . 17.7 p-80 -133.13 130.05 38.72 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.302 -0.408 . . . . 73.44 110.481 177.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 68.7 140.02 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.099 -0.955 . . . . 75.14 112.348 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.482 ' H ' HD13 ' A' ' 20' ' ' LEU . 98.8 m-85 58.1 -105.77 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.205 -1.361 . . . . 74.04 111.352 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 75' ' ' LEU . 12.0 tp 172.36 107.46 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 123.764 0.665 . . . . 75.24 109.537 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -71.73 -25.68 62.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 74.3 109.966 176.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.0 m 69.08 -55.03 0.56 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.116 -0.947 . . . . 65.14 112.189 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.12 -43.7 91.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.689 0.28 . . . . 71.11 111.733 -177.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 84.1 t -64.12 -46.28 94.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.476 -0.329 . . . . 71.03 111.74 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.51 ' CD1' HD13 ' A' ' 10' ' ' LEU . 6.0 tp -70.51 -33.86 55.2 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 119.989 -0.685 . . . . 65.35 109.79 176.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.63 99.69 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.797 -0.716 . . . . 61.42 111.587 176.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.95 -32.02 71.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 70.54 110.907 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.834 -0.621 . . . . 74.12 111.065 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 35' ' ' SER . 0.7 OUTLIER -92.04 13.56 18.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 73.1 111.926 -176.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.696 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 67.7 m . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 110.028 -0.36 . . . . 72.41 110.028 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.0 ttm . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 120.92 0.39 . . . . 73.14 110.82 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -64.87 151.67 44.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.273 -0.421 . . . . 72.33 111.136 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -119.1 142.36 47.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.838 -0.619 . . . . 72.32 109.404 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -154.67 163.93 39.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.416 -0.356 . . . . 71.22 110.667 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.1 m -119.93 -177.84 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.177 -0.465 . . . . 75.54 110.622 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -88.8 163.07 36.62 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.755 -0.657 . . . . 72.44 109.439 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 162.92 40.67 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.118 1.879 . . . . 74.34 111.461 177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -101.52 173.27 6.51 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.366 -0.379 . . . . 75.23 110.482 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 19.8 mtpt -135.05 126.6 28.78 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.975 -0.557 . . . . 74.41 109.946 174.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.443 HD13 HD11 ' A' ' 80' ' ' ILE . 37.0 mt -108.45 120.79 43.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.868 -0.605 . . . . 75.25 110.305 173.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.498 HG23 ' HB3' ' A' ' 40' ' ' GLU . 79.6 t -102.11 126.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.726 -0.67 . . . . 73.43 109.573 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.59 HG23 HD22 ' A' ' 61' ' ' LEU . 59.2 t -96.55 105.98 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 109.193 -0.669 . . . . 64.33 109.193 175.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.573 ' O ' HG21 ' A' ' 60' ' ' VAL . 35.6 m-85 -82.95 105.15 13.71 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.26 -0.644 . . . . 74.21 109.26 174.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.57 -168.15 12.65 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.568 -0.825 . . . . 74.35 111.488 -177.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.41 ' CG ' HG13 ' A' ' 58' ' ' VAL . 3.1 ptm180 -169.76 -159.03 0.2 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.882 -0.784 . . . . 74.42 108.882 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.98 109.04 0.28 Allowed 'General case' 0 C--N 1.318 -0.793 0 O-C-N 124.185 0.928 . . . . 73.21 109.271 171.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -155.31 -170.69 21.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.299 -0.953 . . . . 74.12 112.8 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.02 -155.09 0.59 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.562 0.22 . . . . 73.42 110.424 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.523 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.9 p-80 -52.92 -33.23 49.69 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.988 1.107 . . . . 74.44 113.988 -170.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 20' ' ' LEU . 16.8 mt -56.62 -34.75 67.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.602 0.637 . . . . 72.42 112.025 -176.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.45 ' O ' HG13 ' A' ' 25' ' ' ILE . 37.0 t -63.62 -43.9 95.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.425 -178.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -85.24 -21.29 29.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.52 -0.309 . . . . 73.51 111.29 -177.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.7 mt-10 -66.19 -44.74 83.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.864 0.364 . . . . 72.14 110.121 175.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.542 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.9 mtp -62.77 -40.58 97.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.001 -0.545 . . . . 75.43 110.28 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.537 HG23 HD23 ' A' ' 39' ' ' LEU . 83.6 mt -58.35 -49.85 80.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 72.23 110.562 176.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.48 94.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.362 -0.381 . . . . 63.23 111.194 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -61.3 -43.38 98.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.032 -0.531 . . . . 73.52 110.579 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.621 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 83.1 mt -66.04 -30.8 71.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 75.01 111.2 -179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -63.16 -38.67 92.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.95 0.405 . . . . 74.34 110.411 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.9 t -73.4 -40.54 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 73.34 110.617 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 31' ' ' LEU . 6.8 mt -64.81 -31.79 73.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 74.1 111.142 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -58.23 -24.85 60.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.719 0.295 . . . . 72.0 111.701 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -70.22 -28.97 65.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 74.54 110.537 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -93.71 -44.8 7.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 72.43 110.462 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.514 ' HB3' HD13 ' A' ' 84' ' ' LEU . 50.4 m -143.17 117.86 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.673 -0.694 . . . . 71.04 110.142 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.9 t-105 -78.13 128.92 34.53 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.11 0.481 . . . . 62.11 110.834 -178.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.621 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 2.6 p90 -141.72 20.18 2.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 70.21 110.82 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 59.28 -178.2 0.09 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.147 0.499 . . . . 72.51 110.849 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.537 HD23 HG23 ' A' ' 25' ' ' ILE . 4.5 tp -151.6 109.9 3.76 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.686 -0.405 . . . . 71.24 110.718 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.498 ' HB3' HG23 ' A' ' 11' ' ' VAL . 24.1 tt0 -124.15 117.65 25.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.842 -0.617 . . . . 75.11 109.426 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.57 124.07 68.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.134 -0.484 . . . . 75.15 109.866 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.0 mt -128.9 117.75 45.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.419 -0.355 . . . . 71.53 111.176 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -67.69 114.47 6.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.998 -0.546 . . . . 65.02 111.047 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.6 pt -83.38 -8.85 11.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.452 -0.34 . . . . 75.25 110.62 177.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -74.97 -17.13 60.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 74.14 110.581 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.31 -8.58 59.87 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.942 -0.646 . . . . 62.51 111.954 177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -125.71 101.08 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.966 -0.383 . . . . 70.3 109.966 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -54.43 -33.87 60.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.898 -0.592 . . . . 74.23 112.017 -174.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -66.57 -37.53 85.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 75.11 110.263 -177.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.515 HD21 HD13 ' A' ' 53' ' ' LEU . 74.8 mt -74.9 -24.41 58.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.373 -0.376 . . . . 61.21 110.284 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.8 m -64.99 -33.68 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.407 0.622 . . . . 63.15 109.62 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 mmt85 -77.37 -32.51 55.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.864 -0.607 . . . . 72.51 110.207 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.515 HD13 HD21 ' A' ' 50' ' ' LEU . 82.7 mt -79.15 -24.38 43.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.531 -0.759 . . . . 72.13 111.627 -178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -136.44 -75.51 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.645 0.239 . . . . 73.51 111.645 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.3 t30 46.33 -86.71 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.887 0.875 . . . . 73.52 112.882 -171.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -91.29 49.68 1.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.639 0.733 . . . . 73.25 110.29 -173.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.56 ' O ' HG22 ' A' ' 60' ' ' VAL . 5.7 ttm-85 -156.44 32.05 0.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.703 -1.221 . . . . 73.2 107.703 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.742 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -141.93 0.0 OUTLIER Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.272 0.841 . . . . 72.21 113.272 -166.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.742 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 41.0 Cg_exo -2.53 73.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 122.305 2.003 . . . . 72.14 112.956 -136.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.573 HG21 ' O ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -93.42 116.13 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 114.766 -1.107 . . . . 65.34 111.044 -169.213 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.59 HD22 HG23 ' A' ' 12' ' ' VAL . 32.9 mt -82.65 103.02 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.092 0.472 . . . . 75.4 110.35 173.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.495 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 82.1 t80 -95.19 126.05 40.25 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.171 -0.922 . . . . 72.45 110.013 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.98 108.26 15.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.146 -0.479 . . . . 73.35 110.739 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.433 ' CG2' HG22 ' A' ' 11' ' ' VAL . 51.0 t -77.93 147.19 7.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.11 -0.495 . . . . 72.23 109.731 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 67.45 26.35 8.32 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.076 -0.713 . . . . 74.14 109.076 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.404 ' HG3' ' HG3' ' A' ' 68' ' ' LYS . 7.7 tp10 -149.27 -45.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.051 -0.977 . . . . 71.23 109.433 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.495 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 t70 73.28 37.63 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.972 -1.013 . . . . 75.54 111.591 172.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -149.47 167.04 27.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.137 -0.483 . . . . 74.43 110.045 176.277 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -94.24 157.97 15.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.025 0.44 . . . . 64.14 111.633 -172.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.459 ' CD1' HD12 ' A' ' 80' ' ' ILE . 54.2 mt -112.7 -62.81 1.53 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 73.45 110.033 173.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.3 t -153.8 153.6 32.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 70.13 110.098 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.471 ' CD2' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -128.43 149.35 50.6 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.962 -0.385 . . . . 74.42 109.962 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 74.85 -33.64 0.25 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.81 0.844 . . . . 75.35 113.037 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -141.48 -177.91 5.38 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.016 -0.735 . . . . 75.41 109.016 -174.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 tp -121.1 111.93 18.05 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.779 -0.368 . . . . 74.33 111.195 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -90.69 98.3 11.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.185 -0.672 . . . . 65.45 109.185 175.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.0 m -61.55 -32.09 72.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.09 -0.505 . . . . 74.42 111.635 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.4 -48.33 67.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.86 0.362 . . . . 63.43 110.774 -176.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -66.86 -48.82 78.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.235 -0.439 . . . . 70.14 111.993 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.478 HD11 HD21 ' A' ' 84' ' ' LEU . 8.6 tp -69.69 -30.72 45.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.432 -0.507 . . . . 71.22 110.189 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -30.48 77.69 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.805 -0.712 . . . . 73.32 111.61 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.7 -37.82 55.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.927 0.394 . . . . 74.32 110.697 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -78.69 -54.86 5.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.021 -0.536 . . . . 72.42 111.515 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.514 HD13 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -76.3 -38.4 56.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.126 -0.488 . . . . 73.22 110.851 -175.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 115.557 -0.747 . . . . 74.21 111.243 -176.694 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.418 0.152 . . . . 70.23 111.267 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -56.59 -51.81 67.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.797 0.332 . . . . 65.44 110.891 -177.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -110.68 99.57 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.223 -0.444 . . . . 74.2 110.764 -179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.81 84.18 6.39 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.019 -0.734 . . . . 73.33 109.019 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.6 m -85.2 132.79 30.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.568 -0.742 . . . . 72.31 111.264 -176.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -133.15 158.07 76.71 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.098 -0.956 . . . . 73.41 109.504 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.79 132.12 24.2 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.52 2.147 . . . . 71.34 113.025 -172.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.976 ' NH1' ' O ' ' A' ' 85' ' ' SER . 8.7 ptp180 -88.31 130.34 35.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.589 -0.893 . . . . 75.23 108.589 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.538 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 84.5 tttt -96.09 155.98 16.53 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.134 0.42 . . . . 71.34 112.134 -166.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.557 HD13 HD11 ' A' ' 80' ' ' ILE . 89.7 mt -125.85 148.3 49.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.908 -0.587 . . . . 71.4 110.215 173.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.596 HG21 HG21 ' A' ' 64' ' ' VAL . 55.1 t -127.03 135.51 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 116.239 -0.437 . . . . 71.3 109.958 175.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.742 HG22 HD22 ' A' ' 61' ' ' LEU . 86.8 t -108.85 119.62 58.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.344 -0.389 . . . . 73.13 110.155 176.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -95.9 115.84 28.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.843 -0.429 . . . . 63.51 109.843 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.446 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -139.07 -170.48 11.86 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.379 -0.915 . . . . 65.02 112.104 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -154.48 -177.35 6.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.827 -0.434 . . . . 74.12 109.827 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -78.32 155.6 30.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.146 -0.479 . . . . 72.52 110.825 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.33 31.87 45.03 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.937 -0.649 . . . . 73.43 112.138 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.1 m -143.09 94.08 2.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.803 0.335 . . . . 73.43 110.918 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -70.93 -28.75 64.73 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.24 0.543 . . . . 74.22 110.031 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.46 -34.45 64.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.09 -0.959 . . . . 71.3 110.279 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.9 t -68.13 -37.19 80.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 75.14 110.197 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.406 ' HA ' HD13 ' A' ' 25' ' ' ILE . 40.6 mt-10 -68.92 -33.14 73.26 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.217 0.532 . . . . 73.43 110.094 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.08 -36.7 84.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.657 -0.701 . . . . 73.13 110.409 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.481 ' HE1' ' O ' ' A' ' 74' ' ' PHE . 85.2 mtp -63.99 -43.97 94.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.026 -0.533 . . . . 65.22 109.928 174.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.406 HD13 ' HA ' ' A' ' 22' ' ' GLU . 81.0 mt -55.05 -49.57 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.944 -0.571 . . . . 74.42 110.99 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.15 93.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.933 0.397 . . . . 72.01 110.919 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -62.98 -41.36 99.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.798 -0.637 . . . . 64.14 110.688 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.53 HD23 HD13 ' A' ' 39' ' ' LEU . 8.3 mp -66.45 -33.25 75.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.774 -0.648 . . . . 65.53 111.396 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 29' ' ' ARG . 8.9 mmm180 -62.36 -42.19 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.893 0.378 . . . . 74.42 110.372 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 62.8 t -66.38 -44.37 90.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 71.12 110.71 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.8 mt -63.72 -33.61 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.53 -0.305 . . . . 75.14 111.505 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -58.4 -22.41 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.872 0.367 . . . . 74.33 111.898 178.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -81.91 -11.45 58.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.165 0.507 . . . . 62.4 110.769 -178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -110.56 -44.23 3.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.622 -0.717 . . . . 73.13 109.961 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.437 ' HB3' HD12 ' A' ' 84' ' ' LEU . 73.0 m -137.92 115.2 11.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.998 -1.001 . . . . 63.25 109.535 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -80.86 125.16 29.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.065 0.46 . . . . 71.02 110.806 -178.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.852 ' HB3' HD13 ' A' ' 84' ' ' LEU . 5.6 p90 -134.37 17.74 3.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.582 -0.736 . . . . 73.25 110.869 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 59.98 -179.41 0.09 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.33 0.586 . . . . 75.52 110.304 -175.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.53 HD13 HD23 ' A' ' 28' ' ' LEU . 5.2 tp -152.54 112.55 4.0 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.538 -0.465 . . . . 75.52 111.291 172.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' HG22 ' A' ' 11' ' ' VAL . 22.7 tt0 -120.01 117.8 28.98 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.412 -0.588 . . . . 74.02 109.412 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.5 t -105.61 108.23 24.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.945 -0.571 . . . . 75.31 109.694 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.4 mt -108.5 113.02 42.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.852 -0.613 . . . . 73.04 110.526 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.7 m120 -81.1 124.77 29.49 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.644 . . . . 74.2 110.17 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.64 HG22 ' HB3' ' A' ' 50' ' ' LEU . 43.0 pt -69.97 -30.12 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.334 -0.394 . . . . 74.33 110.106 177.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.7 94.29 0.09 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.208 0.527 . . . . 63.25 109.874 170.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.02 -27.94 2.27 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.55 -1.02 . . . . 73.31 110.55 -174.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -120.65 109.29 15.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.938 -0.393 . . . . 72.43 109.938 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -58.5 -42.75 88.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.048 -0.524 . . . . 75.35 110.712 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -58.48 -41.26 84.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.411 . . . . 75.25 111.25 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.64 ' HB3' HG22 ' A' ' 44' ' ' ILE . 80.9 mt -76.31 -30.33 57.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.585 -0.279 . . . . 73.13 110.901 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.4 m -61.96 -45.35 94.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.085 0.469 . . . . 74.2 110.081 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -63.99 -30.91 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.063 -0.517 . . . . 75.24 110.926 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.07 -44.28 12.41 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.084 0.772 . . . . 75.43 113.084 -174.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -117.03 -2.92 11.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.817 1.043 . . . . 74.51 113.817 -167.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -77.76 82.85 4.13 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 119.485 -0.886 . . . . 73.24 111.219 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.0 t70 171.63 -48.29 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 114.557 -1.201 . . . . 72.1 108.484 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 60' ' ' VAL . 18.0 ptt180 -109.1 54.11 0.67 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.419 -1.264 . . . . 72.45 109.613 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.787 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -144.97 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 112.228 0.455 . . . . 74.54 112.228 -171.402 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.787 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 67.8 Cg_exo -4.89 77.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.642 0 C-N-CA 122.599 2.199 . . . . 72.41 113.72 -138.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -92.12 128.05 43.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.087 -0.96 . . . . 74.22 110.469 -171.641 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.742 HD22 HG22 ' A' ' 12' ' ' VAL . 2.1 tm? -102.03 108.11 19.44 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.381 -0.599 . . . . 75.21 109.381 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -99.86 141.91 32.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.347 -0.842 . . . . 75.21 111.258 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.61 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -92.38 111.5 23.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.594 . . . . 73.22 111.0 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.596 HG21 HG21 ' A' ' 11' ' ' VAL . 21.6 t -99.42 88.37 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.587 0.708 . . . . 72.13 110.819 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 175.29 -44.34 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.045 -1.835 . . . . 73.31 106.045 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -125.53 104.83 8.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.71 -1.586 . . . . 61.41 107.474 163.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -52.12 90.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 124.264 0.977 . . . . 64.44 111.741 -175.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -160.85 156.62 25.34 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.842 -1.072 . . . . 74.24 110.105 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -89.84 141.04 29.01 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.637 -0.505 . . . . 74.15 109.637 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.3 mt -94.21 -55.67 3.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.45 110.166 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.2 t -158.63 175.13 14.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.03 -0.532 . . . . 63.0 109.852 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -144.2 136.77 26.84 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.802 -0.444 . . . . 62.23 109.802 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.422 ' HH ' HG21 ' A' ' 58' ' ' VAL . 96.0 m-85 73.99 139.56 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.518 1.136 . . . . 74.21 111.268 -174.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.481 ' O ' ' HE1' ' A' ' 24' ' ' MET . 98.1 m-85 61.15 -141.84 0.5 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.063 -0.971 . . . . 73.51 110.132 175.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' A' ' 75' ' ' LEU . 14.0 tp -153.83 113.93 3.91 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.463 -0.495 . . . . 74.23 110.419 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.407 ' OD2' ' HB ' ' A' ' 79' ' ' VAL . 4.4 p-10 -58.66 -38.99 79.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.653 -0.703 . . . . 74.2 109.965 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.68 -49.8 0.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.364 -0.834 . . . . 65.33 112.004 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -79.22 -40.06 31.65 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.618 0.229 . . . . 64.42 111.618 -176.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.407 ' HB ' ' OD2' ' A' ' 76' ' ' ASP . 54.1 t -69.53 -47.65 70.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.62 0.247 . . . . 74.25 110.535 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.557 HD11 HD13 ' A' ' 10' ' ' LEU . 10.2 tp -65.57 -31.07 52.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.845 -0.342 . . . . 75.42 110.095 174.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.66 -29.14 74.48 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 120.768 -0.73 . . . . 64.33 111.61 176.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.73 -39.58 26.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.265 0.555 . . . . 72.34 110.278 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.61 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 82.3 t80 -71.88 -32.07 67.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.576 -0.738 . . . . 75.42 111.493 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.852 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -92.22 8.12 39.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.118 -0.492 . . . . 71.53 111.323 -178.319 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.976 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 8.3 t . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.176 -0.675 . . . . 65.21 109.176 176.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.947 0.404 . . . . 61.24 110.284 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -167.64 157.91 10.76 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.333 -0.617 . . . . 73.24 109.333 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -103.01 144.35 31.39 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.219 -0.289 . . . . 75.12 110.219 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -106.88 174.85 5.71 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.524 -0.547 . . . . 71.5 109.524 176.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.22 178.4 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.777 0.799 . . . . 65.31 111.893 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -133.16 166.9 25.87 Favored Pre-proline 0 C--N 1.312 -1.04 0 CA-C-N 114.461 -1.245 . . . . 72.12 108.659 -177.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.46 130.06 14.53 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.855 1.703 . . . . 74.43 111.892 -176.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -96.27 -172.45 2.54 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.931 -0.766 . . . . 75.41 108.931 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 26.3 mtpt -139.77 120.09 13.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.235 0.54 . . . . 65.51 111.138 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.506 HD13 HD11 ' A' ' 80' ' ' ILE . 29.7 mt -107.34 123.64 48.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.349 -0.841 . . . . 72.22 110.59 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.56 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 47.8 t -102.28 127.17 56.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.874 -0.603 . . . . 73.13 109.51 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.549 HG22 ' CD2' ' A' ' 61' ' ' LEU . 40.7 t -104.02 108.8 25.47 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.091 -0.504 . . . . 65.32 109.913 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -79.58 112.57 16.97 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.986 -0.746 . . . . 73.43 108.986 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.74 179.67 16.58 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.639 -0.791 . . . . 44.31 112.218 -177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.451 ' HB3' ' HG ' ' A' ' 18' ' ' CYS . 0.3 OUTLIER -151.56 118.57 5.86 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.34 -0.615 . . . . 75.02 109.34 -176.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.69 107.16 0.56 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.933 -0.576 . . . . 73.23 110.883 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.11 -20.01 4.06 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.584 -0.735 . . . . 64.14 111.366 -175.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' HG ' ' HB3' ' A' ' 15' ' ' ARG . 60.5 m -87.56 118.94 27.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.869 0.366 . . . . 71.34 110.264 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.475 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 33.4 t60 -71.41 -33.56 69.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.51 . . . . 72.34 111.328 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.7 mt -65.25 -31.01 71.94 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.778 -0.369 . . . . 74.21 110.842 176.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.405 ' O ' HG13 ' A' ' 25' ' ' ILE . 42.9 t -54.97 -47.31 74.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.079 -0.51 . . . . 73.54 110.989 -178.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -71.16 -32.22 68.65 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.364 -0.38 . . . . 73.25 110.945 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.0 mt-10 -71.61 -34.9 70.24 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.074 -0.512 . . . . 72.32 110.522 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.754 ' HG3' ' HB3' ' A' ' 59' ' ' PRO . 87.1 mmm -63.83 -43.04 97.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.902 -0.59 . . . . 74.23 110.123 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 21' ' ' CYS . 77.1 mt -54.4 -50.58 56.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 75.03 110.78 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.84 -39.74 86.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.343 -0.39 . . . . 65.34 110.973 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -61.64 -44.0 97.8 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.949 -0.569 . . . . 75.23 110.704 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.417 HD21 ' O ' ' A' ' 24' ' ' MET . 4.2 mm? -66.11 -38.46 88.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.96 -0.564 . . . . 75.14 111.299 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 13.1 mmm180 -58.2 -41.83 84.86 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.676 0.274 . . . . 72.51 111.574 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.89 -40.49 81.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.856 0.36 . . . . 74.41 111.056 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -33.55 70.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.02 0.438 . . . . 74.41 109.92 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.59 -30.15 69.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.53 -0.759 . . . . 74.54 110.742 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 29' ' ' ARG . 52.7 mtmt -69.28 -33.62 73.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 75.23 110.749 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -83.15 -46.06 13.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.619 -0.718 . . . . 73.5 110.281 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.406 ' HB3' HD11 ' A' ' 84' ' ' LEU . 21.9 m -135.22 118.24 16.38 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.661 -0.7 . . . . 74.3 109.511 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -76.99 117.81 18.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.476 0.655 . . . . 70.41 111.447 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.472 ' HB3' HD12 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -129.34 22.98 5.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.303 -0.862 . . . . 74.43 110.43 177.427 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.425 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 19.9 mm-40 57.4 -179.93 0.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.501 -175.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 tp -152.55 117.03 4.99 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.877 -0.729 . . . . 73.44 110.778 173.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.557 ' HB3' HG21 ' A' ' 11' ' ' VAL . 14.9 tt0 -124.41 117.39 24.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.872 -0.788 . . . . 60.14 108.872 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 56.3 t -109.04 111.43 36.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.305 -0.407 . . . . 74.31 109.905 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.6 mt -117.86 109.93 29.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.062 -0.517 . . . . 73.21 110.741 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.69 124.82 27.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.978 177.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.7 pt -86.8 -14.55 10.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.56 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.51 -34.67 67.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.841 -0.618 . . . . 75.41 111.82 -174.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.9 27.41 10.09 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.704 -0.76 . . . . 73.25 113.02 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -152.76 115.66 4.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.645 -0.327 . . . . 74.11 110.512 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.69 -34.92 67.9 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.797 0.295 . . . . 73.05 111.797 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -69.34 -53.86 17.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.801 -0.444 . . . . 64.32 109.801 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 mt -65.79 -39.45 90.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.757 -0.656 . . . . 74.5 111.381 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.531 ' HA ' HD12 ' A' ' 44' ' ' ILE . 95.2 m -54.24 -57.72 10.11 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 120.612 0.244 . . . . 71.35 110.753 178.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 -67.54 -31.02 70.83 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 121.069 -0.252 . . . . 75.24 111.264 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -52.39 41.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.54 -0.3 . . . . 74.41 111.52 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -111.47 19.74 17.9 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 112.352 0.501 . . . . 75.2 112.352 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.83 -37.74 80.08 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.224 0.466 . . . . 62.24 110.568 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -103.07 14.11 32.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.7 0.762 . . . . 70.41 109.741 176.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.515 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 14.2 ttm180 -138.44 29.14 2.44 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.897 -0.592 . . . . 73.33 109.648 -176.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.837 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -84.5 -146.42 0.0 OUTLIER Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 118.525 -0.75 . . . . 72.25 109.729 176.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.837 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 35.1 Cg_exo -2.43 70.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.991 0 C-N-CA 122.351 2.034 . . . . 63.21 112.694 -139.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.58 HG22 ' HB3' ' A' ' 72' ' ' HIS . 4.0 p -116.91 139.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-N 114.553 -1.203 . . . . 74.5 110.396 -165.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.549 ' CD2' HG22 ' A' ' 12' ' ' VAL . 58.6 mt -103.13 110.6 22.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.985 0.421 . . . . 75.05 110.923 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.56 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.1 t80 -92.18 120.48 32.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.623 -0.717 . . . . 72.43 109.909 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.97 100.65 9.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.63 . . . . 71.54 110.981 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 97.7 t -79.02 98.83 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.336 -0.393 . . . . 73.23 110.291 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 168.46 -39.53 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.273 -0.876 . . . . 75.14 108.691 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -125.34 1.87 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.521 -0.763 . . . . 71.33 110.672 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.89 81.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.662 -0.699 . . . . 75.42 111.952 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -173.03 149.6 1.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 73.53 110.043 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -88.07 144.93 26.23 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.851 -0.426 . . . . 74.33 109.851 175.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.4 mt -88.36 -51.33 5.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.014 0.435 . . . . 74.31 110.671 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.7 t -150.79 158.84 44.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 70.24 109.898 -177.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.58 ' HB3' HG22 ' A' ' 60' ' ' VAL . 2.2 p80 -136.17 129.43 31.69 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.661 -0.496 . . . . 74.51 109.661 177.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 65.47 121.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 124.18 0.925 . . . . 73.32 110.472 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 69.5 171.75 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.193 -0.912 . . . . 71.34 110.767 -175.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.1 tp -123.24 118.3 27.28 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.751 -0.379 . . . . 72.4 111.83 -169.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -92.64 106.24 18.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.915 -0.584 . . . . 61.21 110.026 173.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.1 m -68.52 -39.42 81.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.012 -0.54 . . . . 74.41 111.534 -176.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.46 -41.11 85.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.945 0.402 . . . . 63.55 111.046 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.4 t -66.52 -41.47 88.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 70.34 111.536 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.506 HD11 HD13 ' A' ' 10' ' ' LEU . 8.4 tp -72.55 -31.67 38.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.188 -0.605 . . . . 74.42 110.022 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.58 78.06 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.748 -0.739 . . . . 64.55 111.554 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.14 -29.83 66.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.757 0.313 . . . . 73.33 111.042 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -87.12 -42.26 13.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 74.11 111.556 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.472 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -69.02 -21.18 64.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.065 -0.516 . . . . 74.34 111.95 -174.474 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.326 -0.452 0 N-CA-C 109.628 -0.508 . . . . 63.23 109.628 176.501 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttp . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.769 0.318 . . . . 74.02 110.296 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -68.08 115.15 7.24 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.846 -0.798 . . . . 64.33 108.846 174.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -79.05 124.99 28.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.505 0.669 . . . . 71.44 111.072 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -112.4 83.61 1.83 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.664 -0.698 . . . . 74.24 109.582 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -91.8 137.66 21.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.699 -0.682 . . . . 74.31 110.003 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -129.06 153.02 80.27 Favored Pre-proline 0 C--N 1.308 -1.214 0 CA-C-N 115.131 -0.941 . . . . 63.2 109.833 -176.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -75.51 177.94 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.341 2.027 . . . . 64.34 111.729 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -91.93 -179.1 5.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.322 -0.622 . . . . 75.32 109.322 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.746 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.3 tmtp? -142.64 115.17 8.53 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.041 0.448 . . . . 70.03 109.918 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.484 HD12 HD11 ' A' ' 80' ' ' ILE . 79.7 mt -105.66 133.37 50.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.941 -0.572 . . . . 73.2 111.131 178.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.581 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 68.2 t -107.34 127.3 63.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.602 -0.726 . . . . 74.32 109.61 172.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.639 HG22 HD23 ' A' ' 61' ' ' LEU . 92.4 t -96.64 112.13 28.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 120.953 0.406 . . . . 71.44 110.206 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.449 ' CB ' HG23 ' A' ' 60' ' ' VAL . 61.1 m-85 -81.91 111.86 18.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.161 -0.472 . . . . 75.54 109.879 175.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -120.92 -161.72 11.49 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 110.361 -1.096 . . . . 75.42 110.361 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -164.48 -53.52 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.692 0.746 . . . . 73.35 112.28 176.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -137.08 -175.19 3.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.606 -0.27 . . . . 71.42 111.068 -169.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -79.0 62.61 3.96 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 116.073 -0.512 . . . . 74.5 113.322 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 m -81.84 134.55 35.43 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.212 -0.662 . . . . 72.3 109.212 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.496 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.0 t60 -68.48 -38.66 81.23 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.504 -0.478 . . . . 73.04 109.836 -176.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 20' ' ' LEU . 23.3 mt -57.37 -31.62 65.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.439 -0.346 . . . . 62.2 111.499 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.443 ' O ' HG13 ' A' ' 25' ' ' ILE . 41.9 t -57.62 -49.5 76.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.452 -0.34 . . . . 75.12 110.426 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -70.63 -29.2 65.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.783 0.325 . . . . 71.12 110.436 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 38.2 mt-10 -70.1 -39.73 75.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.985 0.421 . . . . 73.34 110.151 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 89.9 mmm -64.62 -45.49 86.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.048 -0.524 . . . . 72.53 110.004 174.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 21' ' ' CYS . 81.2 mt -55.41 -49.64 71.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.261 -0.427 . . . . 73.51 110.285 177.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -60.03 -42.81 95.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.706 0.289 . . . . 75.32 110.9 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.2 m -55.79 -49.08 74.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.757 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.449 HD22 HD11 ' A' ' 61' ' ' LEU . 4.2 mm? -67.25 -38.86 85.86 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.155 -0.475 . . . . 73.11 111.155 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 22.8 mmm180 -61.07 -38.75 87.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 71.42 110.987 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 26' ' ' ALA . 93.9 t -68.53 -44.28 83.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.258 -0.428 . . . . 63.52 111.101 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.48 -32.22 73.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.153 0.502 . . . . 70.22 109.732 178.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.443 ' HA ' ' O ' ' A' ' 35' ' ' SER . 35.5 tt0 -64.13 -21.64 66.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.598 -0.728 . . . . 71.32 110.404 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -78.45 -11.84 59.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.585 -0.734 . . . . 71.31 110.943 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.18 -48.48 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.168 0.508 . . . . 73.13 109.716 173.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.443 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 21.7 m -133.81 127.99 33.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.405 -0.816 . . . . 73.25 110.209 -177.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -82.22 131.3 35.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.217 0.532 . . . . 74.13 111.354 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.507 ' HB3' HD23 ' A' ' 84' ' ' LEU . 7.5 p90 -140.21 22.01 2.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.419 -0.81 . . . . 75.25 110.697 177.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 58.2 -176.08 0.08 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.135 -0.484 . . . . 64.21 110.402 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.28 137.03 19.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.759 -0.46 . . . . 71.42 109.759 175.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.54 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . 4.2 tp10 -136.71 143.42 43.34 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.139 -0.689 . . . . 73.33 109.139 174.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -127.9 109.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.999 -0.371 . . . . 75.51 109.999 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.45 HD11 HG13 ' A' ' 11' ' ' VAL . 75.9 mt -123.99 109.85 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.309 -0.405 . . . . 63.35 110.881 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -81.53 111.42 17.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.219 -0.446 . . . . 74.11 110.129 176.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.4 pt -76.97 -2.01 4.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 73.32 111.153 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -61.96 -32.66 73.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.099 -0.501 . . . . 45.22 110.766 -178.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -95.53 0.58 63.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.918 -0.658 . . . . 72.23 112.116 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.68 97.82 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.716 -0.476 . . . . 74.54 109.716 -179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -58.79 -43.04 90.38 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.735 -0.666 . . . . 75.44 111.276 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -76.08 -30.51 58.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.677 0.275 . . . . 60.45 110.851 -172.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.17 -26.69 53.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.818 0.342 . . . . 70.03 110.71 176.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.5 m -59.89 -37.68 80.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.635 176.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -56.41 -32.56 64.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.165 0.507 . . . . 73.15 110.706 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.15 -57.5 2.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.774 -0.648 . . . . 74.22 111.572 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -104.51 13.66 31.37 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.116 0.784 . . . . 74.51 113.116 -166.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -52.59 -58.22 7.49 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.341 0.519 . . . . 55.53 111.852 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -90.7 -3.18 57.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.023 0.439 . . . . 74.42 111.3 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.25 74.52 1.24 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.969 -0.752 . . . . 74.13 108.969 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.838 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -100.52 -141.17 0.0 OUTLIER Pre-proline 0 N--CA 1.439 -1.01 0 CA-C-O 118.37 -0.824 . . . . 75.42 109.835 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.838 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 77.2 Cg_exo -9.03 71.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.806 0 C-N-CA 122.778 2.318 . . . . 72.34 114.351 -140.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.449 HG23 ' CB ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -103.89 136.26 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.423 -0.808 . . . . 75.34 111.583 -173.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.639 HD23 HG22 ' A' ' 12' ' ' VAL . 96.1 mt -93.32 109.22 20.77 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.488 -0.778 . . . . 73.14 110.216 177.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.581 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.0 t80 -92.08 125.5 36.79 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.362 -0.835 . . . . 74.45 109.937 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.501 ' HB2' ' HG3' ' A' ' 68' ' ' LYS . . . -82.64 104.94 13.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 72.24 110.566 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.746 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 85.5 t -70.9 154.29 8.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.567 -0.531 . . . . 74.01 109.567 177.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 78.98 -38.03 0.2 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.714 0.806 . . . . 75.11 110.145 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -87.13 -33.61 19.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.859 -0.61 . . . . 72.43 111.031 175.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.548 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 61.7 66.34 0.85 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.561 0.696 . . . . 65.35 109.905 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 63' ' ' ALA . 3.2 ptpp? -160.23 153.51 21.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.294 -0.866 . . . . 75.45 109.992 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 mp0 -87.66 144.19 26.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.34 -0.615 . . . . 71.2 109.34 174.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.2 mt -109.99 -56.51 2.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.023 0.44 . . . . 74.14 111.291 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 46.6 t -140.76 157.49 45.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.897 -0.592 . . . . 72.52 110.472 -169.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 18.3 p-80 -127.63 -171.96 2.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.344 -0.613 . . . . 74.34 109.344 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -48.88 144.27 4.74 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.606 0.241 . . . . 71.02 111.548 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 71.1 90.15 0.1 Allowed 'General case' 0 C--O 1.236 0.355 0 O-C-N 124.101 0.875 . . . . 74.42 108.827 -165.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.72 126.2 25.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.659 -1.155 . . . . 74.14 111.522 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -75.15 -35.96 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.763 -0.653 . . . . 75.13 110.238 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.37 -48.19 0.68 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.099 -0.955 . . . . 74.23 112.278 178.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.45 -50.6 58.49 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.819 0.303 . . . . 72.11 111.819 -175.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.6 -51.24 75.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 111.782 0.29 . . . . 63.01 111.782 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.791 HD11 HD21 ' A' ' 84' ' ' LEU . 7.1 tp -68.47 -29.57 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 119.834 -0.746 . . . . 74.15 110.298 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.04 -41.35 97.26 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.684 -0.77 . . . . 73.03 111.582 176.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.37 -26.38 68.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.28 0.562 . . . . 62.22 110.633 176.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -88.0 -50.37 6.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.796 -0.638 . . . . 73.32 111.52 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.791 HD21 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -76.52 -39.18 53.74 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.335 0.495 . . . . 74.1 112.335 -172.123 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.7 p . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.778 -0.369 . . . . 74.52 111.345 -173.919 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttp . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.237 -0.283 . . . . 61.55 110.237 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -179.58 127.92 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.29 0.567 . . . . 70.53 111.286 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -129.59 78.17 1.83 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.31 -0.996 . . . . 71.44 108.31 169.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.4 88.91 6.98 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.588 0.709 . . . . 75.33 111.171 -172.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.6 m -104.29 129.85 55.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.036 -0.984 . . . . 75.33 109.126 172.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -132.18 156.45 80.09 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.217 -0.447 . . . . 74.15 110.665 -171.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.4 173.62 10.39 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.754 2.303 . . . . 74.53 112.896 -175.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HG3' ' HA ' ' A' ' 84' ' ' LEU . 0.5 OUTLIER -108.26 -170.23 1.64 Allowed 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.042 -0.725 . . . . 73.02 109.042 178.093 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.61 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 83.6 tttt -146.58 128.68 15.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.081 0.467 . . . . 74.32 110.57 171.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.528 HD12 HD11 ' A' ' 61' ' ' LEU . 80.6 mt -114.96 129.82 56.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 72.25 110.212 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -107.63 126.36 63.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.061 -0.518 . . . . 75.42 109.704 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.569 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 55.8 t -106.09 108.66 25.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.284 0.564 . . . . 63.41 110.058 176.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -81.68 110.62 17.2 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 73.15 109.069 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.539 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -113.95 171.06 13.58 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.448 -0.882 . . . . 60.11 113.019 -173.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.5 ttt180 -159.32 21.7 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.386 -0.968 . . . . 74.22 108.386 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 62.07 -97.64 0.07 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.248 -1.342 . . . . 70.34 110.191 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.47 -89.05 1.31 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.898 -0.668 . . . . 72.43 113.103 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.3 t -143.07 -167.69 2.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.77 0.319 . . . . 74.12 110.944 -173.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -69.15 -30.52 68.78 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 113.047 0.758 . . . . 73.14 113.047 -169.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 73' ' ' TYR . 32.4 mt -53.47 -31.29 45.08 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 120.873 -0.331 . . . . 74.32 111.605 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.473 ' O ' HG13 ' A' ' 25' ' ' ILE . 27.1 t -60.14 -48.45 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.492 -0.322 . . . . 72.22 110.912 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.95 -32.86 63.67 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.754 0.311 . . . . 73.41 110.762 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.09 -41.14 96.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.201 0.524 . . . . 75.34 110.06 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.605 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 89.4 mmm -65.27 -46.34 80.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.718 -0.674 . . . . 74.21 110.803 176.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 21' ' ' CYS . 83.8 mt -56.55 -48.2 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.335 -0.393 . . . . 64.4 111.497 -178.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.17 92.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.068 0.461 . . . . 62.14 110.936 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.6 m -64.67 -39.11 93.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.866 -0.606 . . . . 61.13 111.272 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 24' ' ' MET . 83.3 mt -63.41 -38.72 92.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 75.2 110.95 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.3 mmm180 -62.87 -42.72 99.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 73.33 110.913 -177.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 68.1 t -71.28 -42.48 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.376 -0.375 . . . . 74.45 110.983 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.42 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -66.02 -31.87 73.02 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.048 -0.353 . . . . 71.31 110.048 -179.657 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.99 -28.94 64.86 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.965 0.412 . . . . 75.41 110.907 176.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -79.86 -12.49 59.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 72.23 110.868 -178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -103.63 -41.73 5.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 73.43 109.748 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.402 ' CB ' HD11 ' A' ' 84' ' ' LEU . 43.5 m -148.52 119.13 7.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.089 -0.959 . . . . 71.13 109.13 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -72.28 129.58 38.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 71.23 111.239 -176.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.621 ' HB3' HD12 ' A' ' 84' ' ' LEU . 7.8 p90 -139.53 21.7 2.53 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.67 -0.695 . . . . 72.11 110.932 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 59.15 -177.62 0.09 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.94 0.4 . . . . 73.02 110.309 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 39' ' ' LEU . 7.0 tp -154.3 109.96 3.18 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.485 -0.486 . . . . 64.32 110.476 168.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -114.75 117.87 31.98 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.425 -0.583 . . . . 73.34 109.425 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.7 t -110.84 110.3 31.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.902 -0.59 . . . . 75.12 110.249 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.1 mt -119.6 111.26 32.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.167 -0.47 . . . . 64.33 110.544 -176.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.2 m120 -81.16 113.95 19.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.25 -0.432 . . . . 61.33 110.175 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 51' ' ' THR . 33.8 pt -79.4 0.01 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.926 -0.579 . . . . 73.53 111.964 -173.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.2 -39.52 90.52 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.088 0.471 . . . . 73.34 111.062 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.03 8.73 68.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.777 -0.725 . . . . 65.1 112.753 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -137.71 97.48 3.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.735 0.268 . . . . 74.52 110.557 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -54.22 -33.94 59.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.282 -0.417 . . . . 63.14 110.456 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.3 m170 -57.19 -48.95 77.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.5 -0.773 . . . . 74.43 110.064 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.41 ' HA ' HD12 ' A' ' 53' ' ' LEU . 90.8 mt -77.84 -26.8 49.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.811 -0.632 . . . . 74.22 111.087 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.541 ' HA ' HD12 ' A' ' 44' ' ' ILE . 85.5 m -56.37 -48.97 75.76 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.296 -0.411 . . . . 74.24 111.24 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -66.39 -31.7 72.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.838 0.351 . . . . 75.53 110.836 -176.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 50' ' ' LEU . 71.0 mt -64.32 -48.49 75.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.888 -0.596 . . . . 73.12 111.314 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.08 24.84 10.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.43 -0.35 . . . . 74.35 111.905 -172.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 56' ' ' ASP . 28.1 t-20 -62.36 120.72 11.57 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.023 -0.271 . . . . 73.15 110.43 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 55' ' ' ASN . 20.8 t70 71.66 -3.49 2.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.752 0.786 . . . . 62.4 110.614 -176.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -115.43 32.91 5.76 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.195 -0.669 . . . . 73.14 109.195 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.758 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -82.51 -140.85 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.662 0 CA-C-O 118.636 -0.697 . . . . 75.44 111.071 -176.424 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.758 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 28.1 Cg_exo -3.89 69.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.729 0 C-N-CA 122.536 2.157 . . . . 63.51 113.278 -139.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -92.08 131.41 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-N 114.641 -1.163 . . . . 73.44 110.837 -172.215 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.528 HD11 HD12 ' A' ' 10' ' ' LEU . 2.3 tm? -97.65 101.99 13.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.591 -0.892 . . . . 74.12 108.591 174.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.505 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.2 t80 -95.29 124.55 39.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.866 -1.061 . . . . 73.11 110.435 -175.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 106.17 17.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.052 -0.522 . . . . 63.12 110.58 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.3 t -67.72 152.85 9.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.558 -0.534 . . . . 71.33 109.558 178.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 76.74 -39.01 0.33 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.528 0.731 . . . . 74.01 110.551 -176.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.513 ' HB3' ' CG ' ' A' ' 68' ' ' LYS . 21.2 mm-40 -76.73 -35.98 57.44 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.44 -0.578 . . . . 74.54 109.44 170.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.505 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 0.5 OUTLIER 61.51 41.7 12.24 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.89 -1.05 . . . . 74.13 109.479 179.509 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.513 ' CG ' ' HB3' ' A' ' 66' ' ' GLU . 1.2 ptpp? -142.15 164.5 30.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.036 -0.984 . . . . 73.1 110.471 -178.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -87.47 134.68 33.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.209 -0.451 . . . . 75.34 110.079 174.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.27 -49.99 6.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.255 -0.646 . . . . 71.25 109.255 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.9 t -168.15 165.97 13.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.984 -0.747 . . . . 73.43 108.984 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.606 ' HD2' ' CD2' ' A' ' 73' ' ' TYR . 49.5 p-80 -144.17 143.99 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 121.202 -0.199 . . . . 63.54 110.661 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.606 ' CD2' ' HD2' ' A' ' 72' ' ' HIS . 64.3 m-85 74.15 -34.65 0.28 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 124.129 0.893 . . . . 72.23 111.785 -176.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.411 ' H ' ' C ' ' A' ' 72' ' ' HIS . 58.1 m-85 -126.51 165.48 19.05 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.616 -0.513 . . . . 75.35 109.616 -176.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.7 tp -119.71 103.37 9.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.987 0.422 . . . . 72.41 111.017 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.29 96.63 10.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.812 -0.631 . . . . 71.52 109.567 174.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.484 ' HA ' HG21 ' A' ' 80' ' ' ILE . 8.6 m -61.56 -30.1 70.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.674 -0.693 . . . . 72.33 111.472 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -64.18 -42.53 96.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 74.12 110.558 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 71.0 t -75.52 -44.37 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 74.23 111.359 -177.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.506 HD11 HD11 ' A' ' 10' ' ' LEU . 8.0 tp -66.44 -34.32 69.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.358 -0.537 . . . . 72.35 110.269 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.08 91.49 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.882 -0.675 . . . . 74.04 111.779 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.77 -33.38 75.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 73.01 111.038 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -87.35 -40.19 14.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.971 -0.559 . . . . 75.04 111.88 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -76.8 2.41 14.52 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.699 0.629 . . . . 71.24 112.699 -171.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--N 1.319 -0.729 0 N-CA-C 110.224 -0.288 . . . . 72.32 110.224 176.342 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.448 0.642 . . . . 73.41 110.066 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -146.13 13.82 1.28 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.182 -0.463 . . . . 72.23 110.619 -173.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.12 100.34 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.769 0.668 . . . . 71.5 110.551 -174.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -84.92 96.24 9.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 73.13 110.229 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.5 m -86.07 131.31 34.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.908 -0.587 . . . . 62.41 110.64 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -60.5 162.35 11.56 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 114.859 -1.064 . . . . 74.44 111.126 -178.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.98 144.74 43.51 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.306 2.004 . . . . 73.1 112.312 -177.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.56 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -111.9 138.79 48.04 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.82 -0.807 . . . . 72.5 108.82 175.864 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 77.9 tttt -88.05 149.79 23.77 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.281 0.562 . . . . 54.51 112.501 -167.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.471 HD12 HD13 ' A' ' 80' ' ' ILE . 75.2 mt -115.45 131.78 56.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.274 -0.876 . . . . 75.55 110.717 174.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.568 HG22 ' CG2' ' A' ' 64' ' ' VAL . 52.5 t -104.33 133.81 47.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 75.22 109.42 172.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.496 HG23 HD21 ' A' ' 61' ' ' LEU . 21.8 t -98.86 105.7 17.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 C-N-CA 120.165 -0.614 . . . . 75.54 109.426 172.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.691 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 23.6 m-85 -72.13 154.42 41.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 109.189 -0.671 . . . . 73.12 109.189 174.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.55 ' HA2' HG12 ' A' ' 58' ' ' VAL . . . 156.01 -145.27 11.98 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.248 -0.977 . . . . 64.15 111.963 175.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 8.9 ptm180 -161.03 177.27 10.5 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.447 -0.575 . . . . 73.42 109.447 176.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -77.88 111.48 13.75 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.113 0.482 . . . . 75.23 111.656 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.71 63.43 0.2 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.852 -0.613 . . . . 64.12 112.669 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -148.38 115.34 6.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 71.33 110.814 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.45 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 57.1 t60 -70.91 -39.14 72.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.359 -0.382 . . . . 73.03 111.388 -176.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.432 HD21 ' OE2' ' A' ' 23' ' ' GLU . 15.8 mt -59.72 -31.18 69.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.877 0.37 . . . . 75.03 110.986 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.586 ' O ' HG13 ' A' ' 25' ' ' ILE . 35.3 t -61.04 -45.89 92.93 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.591 -0.522 . . . . 60.03 109.591 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.409 ' O ' ' HB ' ' A' ' 25' ' ' ILE . 30.2 mt-10 -60.73 -47.75 84.9 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.853 -0.612 . . . . 62.15 110.733 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 31.9 mt-10 -63.22 -38.3 90.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.419 -0.809 . . . . 73.1 111.619 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 45.5 mtp -72.13 -27.94 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.667 -0.413 . . . . 74.4 110.852 177.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 21' ' ' CYS . 67.6 mt -59.12 -45.91 92.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.986 -0.375 . . . . 70.45 109.986 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.97 -41.73 96.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.088 -0.505 . . . . 64.31 110.746 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 m -65.18 -42.38 93.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.009 -0.541 . . . . 73.33 110.719 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 24' ' ' MET . 79.0 mt -67.27 -31.95 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 75.45 111.101 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.6 mmm-85 -62.11 -44.02 97.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.07 0.462 . . . . 71.54 110.156 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 57.9 t -62.97 -41.46 92.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 73.12 110.492 177.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.1 -33.86 75.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.359 -0.382 . . . . 74.44 110.284 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 35' ' ' SER . 39.8 mt-30 -61.23 -20.86 63.3 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.754 0.312 . . . . 64.35 111.484 177.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -78.74 -17.72 55.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.168 0.509 . . . . 71.54 110.687 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -99.09 -45.98 5.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 74.14 109.563 176.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 25.5 m -144.88 122.83 12.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.367 -0.833 . . . . 71.11 109.559 -178.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -78.68 135.33 37.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.642 0.258 . . . . 72.53 110.651 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.513 ' HB3' HD12 ' A' ' 84' ' ' LEU . 8.2 p90 -146.01 14.23 1.32 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.487 -0.324 . . . . 74.11 111.561 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 54.9 -174.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.626 0.726 . . . . 53.52 111.203 -175.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 39' ' ' LEU . 6.0 tp -150.85 109.8 3.89 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.83 -0.623 . . . . 75.4 110.351 174.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.536 ' HB3' HG23 ' A' ' 11' ' ' VAL . 6.2 tp10 -108.7 147.17 32.33 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 75.24 110.225 -178.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -123.65 125.62 71.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.605 -0.517 . . . . 74.12 109.605 176.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.46 HD13 HG12 ' A' ' 11' ' ' VAL . 77.7 mt -135.43 119.87 26.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.919 0.39 . . . . 72.33 110.804 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.6 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 42.6 m-80 -80.66 129.61 34.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 73.3 111.311 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 51' ' ' THR . 28.0 pt -88.56 -15.48 9.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.948 -0.569 . . . . 75.33 110.323 175.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -48.48 -45.67 37.16 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.283 -0.872 . . . . 74.14 112.472 -172.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -87.78 -0.58 83.66 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.654 -0.784 . . . . 64.32 113.276 -176.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -110.42 111.82 23.34 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.165 -0.309 . . . . 72.32 110.165 -177.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.28 -47.29 78.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.995 -0.548 . . . . 72.2 111.721 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -70.75 -37.9 73.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.69 0.281 . . . . 75.22 110.475 -174.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.3 mt -69.22 -33.07 72.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 71.53 110.54 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.458 ' HA ' HD12 ' A' ' 44' ' ' ILE . 94.3 m -57.69 -56.76 17.72 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.188 -0.46 . . . . 61.13 110.475 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.789 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.54 -29.9 68.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.753 0.279 . . . . 75.15 111.753 -178.437 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.6 mt -75.76 -48.13 23.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.466 0.543 . . . . 73.01 112.466 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -122.83 7.87 9.37 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 113.621 0.971 . . . . 74.41 113.621 -167.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -59.86 -50.42 73.86 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 118.746 0.703 . . . . 74.24 111.766 -176.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -77.12 -20.58 55.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.907 -0.588 . . . . 62.54 111.169 -175.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -128.63 75.15 1.61 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.303 -0.628 . . . . 74.12 109.303 175.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.851 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.19 -142.92 0.0 OUTLIER Pre-proline 0 N--CA 1.438 -1.061 0 CA-C-O 117.823 -1.084 . . . . 74.45 109.335 176.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.851 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 94.7 Cg_exo -10.96 101.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.954 0 C-N-CA 122.32 2.013 . . . . 74.31 113.787 -141.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.445 ' HA ' ' CB ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -129.43 142.82 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 123.427 0.455 . . . . 72.35 110.98 -176.317 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 1.03 ' HG ' ' HD2' ' A' ' 72' ' ' HIS . 22.7 mt -88.11 123.3 32.63 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.094 0.473 . . . . 75.03 111.539 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.495 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 89.7 t80 -105.28 129.9 53.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.083 -0.962 . . . . 74.51 110.296 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 83' ' ' TYR . . . -80.43 104.07 10.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.165 -0.47 . . . . 73.43 110.926 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.568 ' CG2' HG22 ' A' ' 11' ' ' VAL . 46.9 t -80.79 81.78 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.964 0.412 . . . . 75.21 110.668 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 172.92 -59.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.124 -0.944 . . . . 64.22 108.963 177.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.05 -7.9 52.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.554 -0.748 . . . . 74.35 110.35 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.4 t70 60.58 78.79 0.27 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.522 0.677 . . . . 74.44 111.395 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -171.42 148.42 2.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.486 -0.779 . . . . 74.53 110.932 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.2 137.69 38.28 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.748 -0.464 . . . . 53.23 109.748 174.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 mt -98.97 -82.41 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.9 0.381 . . . . 73.42 110.447 178.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.401 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 45.6 t -166.37 148.59 6.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 64.05 109.96 -177.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 1.03 ' HD2' ' HG ' ' A' ' 61' ' ' LEU . 4.9 t-80 -146.28 -170.54 3.52 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.483 -0.562 . . . . 75.51 109.483 176.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 101.39 -75.74 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.306 1.443 . . . . 72.44 111.412 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -125.56 8.03 7.65 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.174 -0.21 . . . . 74.3 111.272 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.7 tp 71.88 122.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.972 0.795 . . . . 74.43 111.913 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.401 ' OD1' ' HB3' ' A' ' 71' ' ' CYS . 6.1 p-10 -85.56 -40.3 16.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.677 -0.692 . . . . 64.33 110.894 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 61.35 21.17 11.75 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.89 -0.596 . . . . 70.3 111.242 -177.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -127.24 -53.0 1.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.355 0.598 . . . . 73.24 110.354 -175.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.3 t -75.76 -42.93 40.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.514 -0.767 . . . . 72.25 109.904 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.603 HD13 HD23 ' A' ' 84' ' ' LEU . 7.7 tp -66.05 -31.62 54.49 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.239 0 N-CA-C 109.604 -0.517 . . . . 61.4 109.604 174.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.6 -30.14 75.9 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.824 -0.703 . . . . 71.22 111.717 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.57 -27.62 51.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.086 0.469 . . . . 73.45 110.505 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.56 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 69.4 t80 -87.35 -45.41 10.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 65.1 111.817 -177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.603 HD23 HD13 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -74.9 -8.51 56.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.142 -0.481 . . . . 71.11 111.783 -172.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.815 -0.439 . . . . 65.24 109.815 175.082 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.5 mmt . . . . . 0 N--CA 1.478 0.936 0 N-CA-C 109.858 -0.423 . . . . 74.11 109.858 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.01 90.85 8.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.865 -0.421 . . . . 73.43 109.865 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -79.85 81.63 6.08 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.495 178.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -69.54 110.63 4.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.37 -0.832 . . . . 65.52 108.89 174.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.1 m -67.43 158.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 122.006 0.908 . . . . 74.15 112.539 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.24 156.85 68.88 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 113.869 -1.514 . . . . 73.42 109.994 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -86.83 174.4 5.6 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.435 2.09 . . . . 72.13 112.903 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -107.58 -176.87 3.19 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.258 -1.015 . . . . 72.14 108.258 176.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.9 tmtp? -150.33 132.34 15.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.415 -0.587 . . . . 72.11 109.415 175.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.543 HD12 HD13 ' A' ' 61' ' ' LEU . 92.7 mt -127.77 138.96 52.92 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 71.4 110.57 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' A' ' 40' ' ' GLU . 77.0 t -114.88 137.84 47.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 75.52 110.08 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.643 HG21 HD21 ' A' ' 61' ' ' LEU . 86.0 t -110.14 113.48 44.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.997 0.427 . . . . 73.54 110.18 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.486 ' CB ' HG23 ' A' ' 60' ' ' VAL . 95.2 m-85 -87.11 128.33 35.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.929 -0.767 . . . . 73.52 108.929 174.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.518 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -172.82 -163.15 26.12 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.188 -1.006 . . . . 64.33 111.91 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.523 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 13.1 ptm180 -150.69 132.22 14.77 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.369 -0.604 . . . . 73.05 109.369 175.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.49 118.62 7.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.674 -0.694 . . . . 74.41 111.042 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.06 -20.68 1.94 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.38 -0.827 . . . . 64.2 111.601 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.3 p -96.43 128.83 43.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.795 0.331 . . . . 74.24 110.266 177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -69.33 -33.73 73.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.213 0.449 . . . . 74.42 112.213 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.443 HD21 ' OE2' ' A' ' 23' ' ' GLU . 20.4 mt -58.61 -32.02 68.6 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.758 0.313 . . . . 75.32 111.258 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.86 -42.38 93.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 73.12 110.265 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.08 -45.49 91.85 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.111 -0.495 . . . . 74.11 110.386 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.443 ' OE2' HD21 ' A' ' 20' ' ' LEU . 45.6 mt-10 -61.89 -40.08 94.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.443 -0.799 . . . . 74.01 111.144 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.524 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.6 mtp -68.72 -49.19 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.241 -0.436 . . . . 64.52 110.698 177.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -58.77 -47.64 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-N 116.717 -0.22 . . . . 75.04 111.432 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -36.68 74.16 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.094 0.473 . . . . 64.31 111.076 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.6 m -69.72 -41.44 75.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.873 -0.603 . . . . 72.43 110.66 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 24' ' ' MET . 86.1 mt -66.66 -34.32 77.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.301 -0.408 . . . . 74.53 111.018 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -61.55 -41.84 97.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.34 111.236 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.71 -37.56 43.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.866 0.365 . . . . 75.14 110.596 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 1.5 mt -64.48 -31.93 73.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 73.42 110.887 178.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.52 -34.52 50.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.123 -0.49 . . . . 72.32 111.704 176.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -73.86 -23.97 59.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 75.01 111.357 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -93.65 -42.59 9.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.397 0.618 . . . . 75.31 109.965 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.472 ' HB3' HD22 ' A' ' 84' ' ' LEU . 69.9 m -143.54 104.03 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.924 -1.035 . . . . 73.43 109.198 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.7 t-105 -69.27 129.79 40.8 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.898 0.38 . . . . 74.04 111.702 -174.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.649 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 30.4 p90 -142.12 18.18 2.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.777 -0.647 . . . . 75.32 111.596 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 59.5 -179.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.032 0.444 . . . . 75.1 110.402 -177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.9 tp -153.14 132.19 12.6 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 120.099 -0.641 . . . . 72.33 110.808 170.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.49 ' HB3' HG23 ' A' ' 11' ' ' VAL . 7.7 tt0 -136.76 118.19 14.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.551 -0.537 . . . . 75.13 109.551 178.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -107.1 115.82 49.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.525 -0.546 . . . . 73.1 109.525 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.8 mt -115.83 119.69 62.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.775 -175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.523 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 12.0 m-80 -78.23 117.37 19.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 74.43 111.39 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.413 HG23 HD12 ' A' ' 50' ' ' LEU . 23.9 pt -81.01 -7.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 73.33 109.352 174.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -37.69 -46.97 0.94 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.25 -1.341 . . . . 64.15 113.329 -177.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.86 32.41 6.93 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.269 -0.967 . . . . 70.33 113.933 -175.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -139.08 100.28 3.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.069 0.435 . . . . 72.21 110.585 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 51' ' ' THR . 3.7 mp0 -55.38 -33.78 63.74 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.103 0.409 . . . . 73.12 112.103 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -56.89 -45.22 82.74 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.09 -0.337 . . . . 60.32 110.09 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.413 HD12 HG23 ' A' ' 44' ' ' ILE . 80.2 mt -78.64 -39.56 36.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.179 -0.464 . . . . 72.11 110.471 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.507 ' HB ' ' HA ' ' A' ' 48' ' ' GLU . 88.0 m -56.09 -54.03 49.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.194 -0.457 . . . . 64.53 111.679 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -59.06 -30.55 68.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.981 0.42 . . . . 74.21 110.972 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.9 mt -77.05 -53.82 7.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.078 -0.51 . . . . 73.33 111.906 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -116.27 -0.2 12.68 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.487 1.292 . . . . 74.24 114.487 -165.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -59.35 -39.91 84.7 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.843 1.202 . . . . 74.41 111.163 -176.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -84.65 -14.42 48.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.792 -0.64 . . . . 74.24 110.951 178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.418 ' HA ' ' HH ' ' A' ' 73' ' ' TYR . 13.0 ttm180 -143.97 54.12 1.3 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.315 -0.624 . . . . 74.3 109.315 -167.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.554 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.26 -102.66 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.522 0 CA-C-O 118.444 -0.789 . . . . 72.41 111.069 -172.206 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.554 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 16.6 Cg_exo -23.17 75.06 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 122.567 2.178 . . . . 70.34 113.693 -145.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.486 HG23 ' CB ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -102.05 115.51 44.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.719 . . . . 75.43 111.251 -169.229 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.643 HD21 HG21 ' A' ' 12' ' ' VAL . 3.0 tm? -89.19 110.25 21.03 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.572 -0.74 . . . . 74.32 109.587 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -92.25 127.15 37.63 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.111 -0.95 . . . . 74.45 110.693 -176.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.28 95.83 7.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.425 -0.807 . . . . 75.43 111.211 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 42.2 t -77.63 90.76 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.3 0.572 . . . . 72.21 109.487 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 172.19 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.844 -1.071 . . . . 70.1 108.659 -173.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -124.05 -2.59 8.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 64.24 109.928 -178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 58.71 78.74 0.24 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.098 -0.955 . . . . 71.1 112.035 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -174.33 -179.41 1.59 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.39 -0.823 . . . . 75.32 110.332 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -95.09 141.78 28.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.45 -0.341 . . . . 62.22 110.777 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -96.02 -53.9 3.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.388 0.613 . . . . 73.31 109.559 170.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.7 t -156.77 155.47 31.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.312 -0.858 . . . . 75.13 109.374 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 0.5 OUTLIER -145.09 163.8 33.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.568 -0.287 . . . . 60.25 110.382 179.253 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.42 ' O ' HD13 ' A' ' 20' ' ' LEU . 62.5 m-85 74.55 -56.63 0.63 Allowed 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.114 0.884 . . . . 71.5 110.951 -174.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -129.93 -161.95 1.16 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.007 -1.108 . . . . 71.14 108.007 -175.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.8 tp -129.85 113.48 14.71 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.079 -0.648 . . . . 74.01 111.886 -175.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -86.09 86.07 7.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.082 -0.71 . . . . 73.32 109.082 169.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.7 m -59.03 -28.23 66.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 74.41 111.381 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.46 -37.4 68.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.193 -0.458 . . . . 75.35 110.908 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 40.5 t -70.89 -46.59 67.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.193 -0.458 . . . . 72.32 110.977 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.503 HD12 HD11 ' A' ' 10' ' ' LEU . 6.9 tp -68.74 -28.18 38.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.346 -0.541 . . . . 74.25 109.992 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.78 -30.64 78.26 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 111.448 -0.661 . . . . 72.52 111.448 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.3 -33.03 64.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.187 0.517 . . . . 71.41 110.377 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -80.41 -51.42 8.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.96 -0.563 . . . . 71.35 111.038 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.472 HD22 ' HB3' ' A' ' 35' ' ' SER . 13.3 mt -64.87 -50.93 64.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.707 -0.679 . . . . 64.55 111.516 -177.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.576 0.548 . . . . 71.24 111.396 -172.943 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.8 ttp . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 120.671 0.272 . . . . 73.31 110.801 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -81.24 -54.55 5.4 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.042 -0.725 . . . . 72.54 109.042 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 48.3 t30 176.01 -84.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.956 -1.127 . . . . 75.42 107.956 176.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 167.16 80.15 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.444 1.09 . . . . 74.34 108.829 170.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.2 m -95.72 163.41 2.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.671 -0.492 . . . . 71.32 109.671 176.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -132.84 158.53 75.55 Favored Pre-proline 0 C--N 1.31 -1.114 0 CA-C-N 115.518 -0.764 . . . . 73.2 109.748 -176.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -62.34 158.67 39.19 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.654 2.236 . . . . 75.44 113.329 -169.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.2 mmp_? -99.2 -164.36 1.12 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.935 -0.765 . . . . 74.31 108.935 175.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.948 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 4.3 tmtp? -149.76 128.87 12.73 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.544 -0.462 . . . . 71.04 110.858 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.515 HD23 HD11 ' A' ' 61' ' ' LEU . 28.4 mt -116.78 138.67 51.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 75.02 111.294 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.579 HG22 ' HB3' ' A' ' 40' ' ' GLU . 41.2 t -124.34 136.41 60.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.701 -0.681 . . . . 71.11 110.131 175.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.587 HG21 HD22 ' A' ' 61' ' ' LEU . 78.4 t -108.35 120.42 59.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.688 -0.486 . . . . 74.44 109.688 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -83.41 97.43 8.95 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.688 -0.486 . . . . 74.52 109.688 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.18 -176.12 14.3 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.018 -1.087 . . . . 62.31 112.696 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 5.2 ptm180 -158.28 125.44 4.98 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.896 -0.409 . . . . 74.42 109.896 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 55.3 -154.99 0.28 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.963 -0.562 . . . . 70.43 111.592 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.78 145.37 17.41 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.725 -0.75 . . . . 74.53 112.762 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.402 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 51.2 t -156.28 142.81 18.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.431 -0.581 . . . . 75.23 109.431 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.461 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 18.4 m170 -60.38 -48.8 80.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 62.5 111.772 -175.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -34.65 78.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.416 -0.356 . . . . 73.12 110.699 -175.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 84.2 m -64.7 -40.63 95.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.39 . . . . 53.0 110.493 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -61.93 -40.5 95.73 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.038 -0.528 . . . . 74.03 110.218 176.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 35.9 mt-10 -64.73 -36.39 84.14 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.726 -0.67 . . . . 71.12 110.942 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.557 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 82.6 mtp -67.26 -44.69 78.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.466 -0.334 . . . . 73.33 110.432 176.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.63 -47.39 82.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.821 0.343 . . . . 74.24 110.897 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.92 87.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.112 -0.495 . . . . 74.35 110.61 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -64.89 -42.33 94.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 71.21 110.887 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 24' ' ' MET . 95.9 mt -59.31 -45.59 90.89 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 116.164 -0.471 . . . . 64.42 110.569 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 28.1 mmm180 -57.73 -42.63 84.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.39 -0.368 . . . . 73.05 111.255 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.8 t -64.3 -45.41 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.287 -0.415 . . . . 61.13 111.137 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.95 -32.96 65.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.914 0.388 . . . . 64.32 110.146 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -62.78 -26.77 68.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.846 -0.616 . . . . 74.3 110.633 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 29' ' ' ARG . 47.9 mtmt -63.36 -42.5 98.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.771 -0.65 . . . . 74.21 110.485 173.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -79.06 -37.61 38.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.056 -0.974 . . . . 73.44 110.639 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB3' HD11 ' A' ' 84' ' ' LEU . 46.1 m -145.66 124.68 12.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.527 -0.76 . . . . 75.23 109.628 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -83.72 119.49 24.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.312 0.577 . . . . 74.31 111.041 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.589 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 1.5 p90 -130.96 20.63 4.95 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.536 -0.756 . . . . 75.24 110.926 179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.45 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 9.8 mt-10 53.8 -176.83 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.349 0.595 . . . . 75.1 111.027 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.528 HD11 HD13 ' A' ' 28' ' ' LEU . 7.2 tp -152.17 134.9 15.46 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.186 -0.461 . . . . 72.21 110.031 173.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.579 ' HB3' HG22 ' A' ' 11' ' ' VAL . 10.3 tp10 -136.61 143.04 43.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.116 -0.493 . . . . 54.11 110.195 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.2 t -125.75 107.4 17.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.05 -0.722 . . . . 62.24 109.05 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.478 HD12 HG13 ' A' ' 11' ' ' VAL . 62.4 mt -107.86 116.28 50.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.721 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -75.92 106.67 7.63 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.344 -0.844 . . . . 73.33 110.251 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.4 pt -80.17 -9.83 12.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.62 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.59 -42.3 23.61 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.245 -0.889 . . . . 62.03 112.652 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.89 21.06 45.82 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.578 -0.82 . . . . 73.23 113.269 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -129.72 119.62 23.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.028 0.414 . . . . 71.21 110.607 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.23 -20.66 60.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 72.14 111.929 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -77.6 -54.77 6.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.186 0.517 . . . . 74.41 110.363 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.0 mt -65.35 -39.75 92.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.622 -0.717 . . . . 74.34 111.432 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.4 m -61.47 -39.57 91.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.988 0.423 . . . . 75.32 110.788 176.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.07 -31.49 72.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.088 0.47 . . . . 73.53 110.512 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.67 -55.62 4.02 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.741 . . . . 73.23 111.695 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.442 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 49.2 m-85 -109.42 19.55 19.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.104 0.779 . . . . 71.14 113.104 -166.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -54.82 -47.48 74.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.175 0.512 . . . . 73.41 111.285 177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.98 -17.6 56.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.113 -0.494 . . . . 73.41 111.169 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.534 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 9.3 ptt180 -128.26 73.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.073 0.464 . . . . 73.33 110.628 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.44 HG21 ' HD3' ' A' ' 59' ' ' PRO . 1.2 m -90.65 -22.6 0.26 Allowed Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 113.399 0.889 . . . . 74.24 113.399 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.44 ' HD3' HG21 ' A' ' 58' ' ' VAL . 3.8 Cg_exo -79.01 49.33 3.12 Favored 'Trans proline' 0 N--CA 1.443 -1.471 0 CA-C-N 120.629 1.26 . . . . 75.0 110.246 164.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.01 131.44 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.198 -0.91 . . . . 64.44 110.16 -175.271 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.587 HD22 HG21 ' A' ' 12' ' ' VAL . 2.4 tm? -109.34 118.83 37.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.827 -0.624 . . . . 74.33 110.34 -174.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -106.67 136.71 46.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.004 -0.998 . . . . 73.5 110.842 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.542 ' HB2' ' HG ' ' A' ' 70' ' ' LEU . . . -94.52 111.06 22.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.257 -0.428 . . . . 74.43 111.085 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.948 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 60.9 t -86.33 98.76 7.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.013 0.435 . . . . 73.14 109.994 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 177.16 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.076 -1.083 . . . . 64.3 108.076 -176.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -106.16 -11.27 16.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.994 -1.003 . . . . 74.15 109.351 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 67.52 86.99 0.13 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 114.767 -1.106 . . . . 72.51 111.584 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -170.5 157.41 5.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.94 -1.027 . . . . 74.45 109.418 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -82.37 133.88 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.688 0.28 . . . . 73.23 110.399 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.542 ' HG ' ' HB2' ' A' ' 63' ' ' ALA . 53.7 mt -92.59 -46.56 7.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.016 0.436 . . . . 75.12 110.395 178.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.0 t -152.46 157.39 41.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.997 -0.547 . . . . 74.03 111.334 -171.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -128.36 128.82 45.25 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.859 -0.793 . . . . 75.43 108.859 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 67.39 143.8 0.04 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.949 0.781 . . . . 70.31 112.021 -176.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 57.91 -124.16 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.752 -1.113 . . . . 71.02 110.519 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.0 tp -171.19 110.85 0.33 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.94 -0.304 . . . . 74.52 110.732 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.65 89.6 6.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.937 0.399 . . . . 74.11 110.069 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -57.71 -27.9 63.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.333 -0.849 . . . . 73.12 112.07 -176.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.18 -46.09 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 74.31 110.861 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.09 -44.83 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.51 . . . . 71.03 111.281 -176.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.443 HD13 HD12 ' A' ' 10' ' ' LEU . 6.7 tp -64.99 -28.23 44.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.512 -0.475 . . . . 64.34 109.802 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.34 -36.27 89.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.75 -0.738 . . . . 61.02 111.662 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.98 -26.58 65.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.088 0.471 . . . . 61.11 110.785 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -87.92 -43.14 12.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 74.44 111.344 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.58 HD11 ' HB3' ' A' ' 35' ' ' SER . 1.3 mm? -76.07 -37.32 58.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.511 0.56 . . . . 75.34 112.511 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 121.156 -0.218 . . . . 55.34 110.934 -177.092 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 110.137 -0.32 . . . . 74.34 110.137 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -83.57 82.84 8.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.916 0.388 . . . . 75.04 111.543 -177.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -103.22 86.8 2.74 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.006 -1.109 . . . . 71.02 108.006 167.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -73.25 113.63 10.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.93 -1.032 . . . . 73.33 112.181 -166.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.7 m -110.73 147.62 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.514 -0.766 . . . . 72.55 109.845 169.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -88.81 161.92 40.04 Favored Pre-proline 0 C--N 1.31 -1.136 0 CA-C-N 115.222 -0.899 . . . . 65.4 110.416 -177.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -80.35 167.04 19.79 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.513 2.142 . . . . 74.5 113.155 -172.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.596 ' NE ' ' O ' ' A' ' 85' ' ' SER . 80.7 mtt-85 -107.55 -171.92 1.97 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.419 -0.81 . . . . 72.34 109.522 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 48.8 tttt -149.52 139.43 21.93 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.117 -0.633 . . . . 74.02 112.141 -177.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.515 HD11 HD13 ' A' ' 80' ' ' ILE . 71.2 mt -113.53 130.29 56.38 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.346 -0.843 . . . . 75.12 110.57 173.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.504 HG22 ' CG2' ' A' ' 64' ' ' VAL . 79.8 t -107.07 133.16 52.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.137 -0.69 . . . . 73.44 109.137 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.837 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 11.3 t -96.58 105.56 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 109.574 -0.528 . . . . 73.31 109.574 175.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.506 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 12.8 m-85 -78.23 98.71 5.98 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.933 -0.576 . . . . 75.22 110.256 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.66 ' HA2' ' HD3' ' A' ' 59' ' ' PRO . . . -114.31 -171.57 17.31 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.269 -0.967 . . . . 61.14 112.839 -175.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 10.1 ptm180 -161.97 103.42 1.15 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.766 -0.457 . . . . 73.11 109.766 171.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 73.82 -56.03 0.66 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.209 -0.905 . . . . 75.53 112.689 172.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.41 158.57 26.02 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.283 -0.961 . . . . 72.22 113.544 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.1 t -171.94 128.04 0.6 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.261 0.625 . . . . 74.23 109.8 177.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -68.0 -42.29 80.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.473 0.178 . . . . 72.34 111.286 -175.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 16.1 mt -61.83 -30.1 70.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.624 -0.262 . . . . 74.55 111.182 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.533 ' O ' HG13 ' A' ' 25' ' ' ILE . 51.4 t -55.93 -50.94 69.35 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.352 -0.24 . . . . 55.25 110.352 177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.24 -39.13 85.61 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.033 -0.531 . . . . 73.25 111.013 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.09 -39.34 89.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.841 -0.618 . . . . 73.43 111.136 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.49 ' HE3' ' HB3' ' A' ' 24' ' ' MET . 15.2 mtp -71.9 -39.18 69.72 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.516 -0.474 . . . . 73.51 110.311 177.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 21' ' ' CYS . 72.9 mt -54.84 -50.01 64.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 121.347 -0.141 . . . . 73.25 110.759 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.86 84.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.881 0.372 . . . . 74.3 111.17 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -66.96 -44.71 79.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.077 -0.51 . . . . 72.32 110.838 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -67.68 -32.18 72.66 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.32 -0.4 . . . . 75.22 111.31 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -57.98 -39.02 77.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.446 . . . . 73.51 110.814 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.452 ' HA ' ' CE ' ' A' ' 33' ' ' LYS . 80.4 t -67.84 -42.18 85.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.993 -0.549 . . . . 75.1 110.949 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.99 -35.08 77.74 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.808 -0.441 . . . . 75.44 109.808 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.419 ' HA ' ' O ' ' A' ' 35' ' ' SER . 23.7 tt0 -60.86 -26.59 67.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.584 -0.735 . . . . 63.43 110.656 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.452 ' CE ' ' HA ' ' A' ' 30' ' ' VAL . 54.3 mtmt -74.97 -11.23 60.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.636 -0.711 . . . . 72.34 111.383 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.11 -44.74 4.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 75.45 109.842 173.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 17.6 m -131.21 115.92 16.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.055 -177.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -77.24 132.64 38.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.123 0.487 . . . . 75.52 111.344 -177.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.583 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 16.6 p90 -139.99 19.0 2.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.708 -0.678 . . . . 75.23 111.062 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 60.82 -179.61 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.946 0.403 . . . . 64.24 111.286 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -151.14 110.59 3.98 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.28 -0.637 . . . . 74.44 109.28 173.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -121.72 145.03 48.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.513 -0.312 . . . . 54.43 110.324 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.4 117.8 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.961 -0.385 . . . . 73.03 109.961 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -133.43 128.21 54.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.459 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.642 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 98.7 m-20 -83.54 128.71 34.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 71.33 110.46 176.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' A' ' 51' ' ' THR . 20.2 pt -64.75 -47.51 88.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.208 -0.451 . . . . 75.4 109.994 175.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.41 ' N ' HG13 ' A' ' 44' ' ' ILE . 36.5 t70 44.57 -97.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.33 1.052 . . . . 74.32 113.629 173.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.09 -3.97 63.31 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.931 -0.652 . . . . 73.02 113.44 -171.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -80.93 84.35 6.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.75 -0.463 . . . . 71.21 109.75 178.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -53.27 -32.51 48.94 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 73.4 111.124 -177.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -55.4 -46.95 76.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.838 -0.619 . . . . 74.2 110.457 175.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.5 -39.88 36.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.273 -0.421 . . . . 74.55 110.876 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.554 ' HA ' HD11 ' A' ' 44' ' ' ILE . 6.9 m -56.34 -42.0 77.01 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.369 -0.378 . . . . 73.32 111.809 -177.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.22 -34.99 77.54 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.294 0.568 . . . . 72.2 111.095 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.9 mt -78.6 -48.52 14.98 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.442 -0.799 . . . . 74.43 111.33 -176.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.445 ' CD1' HG22 ' A' ' 60' ' ' VAL . 62.4 m-85 -114.18 14.79 18.25 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.031 0.752 . . . . 71.32 113.031 -167.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -53.45 -54.02 42.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.171 0.442 . . . . 75.54 111.3 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -87.8 -0.48 57.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.44 110.461 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.711 ' O ' HG21 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -108.52 5.26 25.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.716 -0.674 . . . . 73.35 110.647 -172.767 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.907 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 2.6 m -54.85 -171.24 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 114.804 1.409 . . . . 73.14 114.804 -163.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.907 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 17.6 Cg_exo -7.07 82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.428 -2.334 0 C-N-CA 122.507 2.138 . . . . 61.52 113.828 -129.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.837 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -90.53 160.26 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 122.551 0.341 . . . . 64.4 111.327 -171.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.718 ' HG ' ' HD1' ' A' ' 72' ' ' HIS . 24.6 mt -97.46 103.03 14.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.281 0.562 . . . . 62.14 109.707 169.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.546 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 70.2 t80 -93.68 128.3 39.8 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.056 -0.975 . . . . 75.11 110.777 -177.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.426 ' HB2' ' CE1' ' A' ' 83' ' ' TYR . . . -78.13 102.82 7.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.027 -0.533 . . . . 75.35 110.273 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.504 ' CG2' HG22 ' A' ' 11' ' ' VAL . 61.7 t -66.47 146.5 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.729 -0.669 . . . . 75.01 110.874 -176.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 81.0 -31.67 0.11 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.176 0.99 . . . . 73.01 112.729 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -98.76 -9.57 24.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 121.17 -0.212 . . . . 74.4 111.505 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.546 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 27.8 t70 48.08 73.47 0.21 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.48 0.657 . . . . 73.34 111.642 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -160.26 148.75 16.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 65.2 110.095 -177.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -95.95 127.62 42.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.294 -0.632 . . . . 74.41 109.294 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.09 -70.12 0.59 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.622 -0.511 . . . . 74.41 109.622 177.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 50.0 t 178.16 140.38 0.09 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.385 -0.825 . . . . 64.24 108.936 177.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.718 ' HD1' ' HG ' ' A' ' 61' ' ' LEU . 6.8 t60 -144.07 130.82 20.22 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.099 -0.64 . . . . 65.02 110.951 170.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.461 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 2.1 m-85 174.59 -70.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 125.314 1.634 . . . . 74.0 107.718 173.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -114.12 -74.52 0.62 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 73.54 110.118 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.0 tp 175.64 141.95 0.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.532 0.333 . . . . 73.14 110.162 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -95.21 -42.52 8.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.387 -0.369 . . . . 65.45 110.617 176.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 m 62.19 20.74 11.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.741 -0.663 . . . . 74.03 111.932 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -139.06 -53.27 0.57 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.615 -0.434 . . . . 70.24 111.092 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.08 -39.25 82.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 73.11 109.71 177.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.515 HD13 HD11 ' A' ' 10' ' ' LEU . 8.1 tp -66.85 -34.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.937 -0.574 . . . . 74.41 109.835 174.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.49 -37.72 94.03 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.63 -0.795 . . . . 73.34 111.242 177.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.22 81.28 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.437 -0.382 . . . . 64.41 110.759 174.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.426 ' CE1' ' HB2' ' A' ' 63' ' ' ALA . 63.7 t80 -67.66 -43.68 79.68 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.087 -0.506 . . . . 74.52 111.72 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.461 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -71.26 13.76 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.327 0.491 . . . . 74.33 112.327 -173.378 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.596 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 18.8 m . . . . . 0 C--N 1.322 -0.602 0 N-CA-C 109.775 -0.454 . . . . 74.23 109.775 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.482 1.175 0 CA-C-O 120.644 0.259 . . . . 74.1 110.313 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -77.82 -58.14 3.42 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.472 -0.936 . . . . 70.53 108.472 173.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.469 ' OD1' ' HG3' ' A' ' 4' ' ' GLN . 25.7 t-20 -102.95 142.09 34.65 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.853 -1.165 . . . . 71.51 107.853 166.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.469 ' HG3' ' OD1' ' A' ' 3' ' ' ASN . 46.0 mt-30 68.75 102.07 0.06 Allowed 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 122.102 0.953 . . . . 70.04 110.088 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.4 m -113.95 -176.31 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-N 114.589 -1.187 . . . . 74.24 111.525 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -75.62 150.87 84.68 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.053 -0.976 . . . . 75.41 109.683 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -76.15 157.97 37.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.661 2.241 . . . . 72.35 113.196 -167.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HD3' ' CZ ' ' A' ' 83' ' ' TYR . 48.7 mtt180 -95.1 -172.02 2.57 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.511 -0.768 . . . . 72.44 109.334 175.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 87.5 tttt -145.58 140.64 27.55 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.335 0.588 . . . . 74.33 111.685 -177.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.539 HD13 ' CD1' ' A' ' 80' ' ' ILE . 61.5 mt -116.91 129.71 56.24 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.092 -0.958 . . . . 74.21 110.427 174.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -105.82 126.66 61.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 116.017 -0.538 . . . . 74.13 109.784 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.701 HG23 HD23 ' A' ' 61' ' ' LEU . 95.9 t -96.95 114.53 34.14 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.137 -0.483 . . . . 73.51 109.949 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -91.9 122.72 34.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 72.41 110.533 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.75 166.03 26.33 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 109.818 -1.313 . . . . 62.42 109.818 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -83.44 -68.82 0.68 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 118.414 1.107 . . . . 73.34 110.093 -178.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.619 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . 1.8 mp0 -121.94 -77.24 0.59 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.2 -0.454 . . . . 51.55 110.114 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -154.04 154.91 25.83 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.389 -0.684 . . . . 72.41 111.389 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.8 t -162.5 145.66 11.32 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.843 -0.428 . . . . 74.1 109.843 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -62.85 -36.19 82.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.696 -0.229 . . . . 65.14 111.215 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -32.39 72.61 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.861 0.363 . . . . 74.32 110.759 178.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.45 ' O ' HG13 ' A' ' 25' ' ' ILE . 49.8 t -68.35 -42.1 79.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.217 -0.447 . . . . 60.55 109.8 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.37 -40.27 96.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.001 -0.545 . . . . 71.11 111.168 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -60.39 -47.06 87.73 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.109 0.481 . . . . 74.0 109.893 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.555 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.1 mtp -61.75 -49.66 75.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.732 -0.667 . . . . 74.44 111.373 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 21' ' ' CYS . 75.0 mt -55.84 -45.63 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.854 -0.157 . . . . 72.14 111.4 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -37.15 78.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.986 0.422 . . . . 74.52 110.93 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.5 m -69.71 -38.4 76.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.61 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 24' ' ' MET . 82.3 mt -63.76 -39.29 93.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 72.33 110.828 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -59.41 -38.29 80.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.097 0.475 . . . . 75.33 110.701 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.96 -38.56 72.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.863 -0.608 . . . . 73.34 110.418 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.461 HD21 ' HA ' ' A' ' 31' ' ' LEU . 10.5 mt -67.67 -32.65 73.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 74.32 111.438 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.5 mt-30 -59.63 -20.99 59.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.901 0.381 . . . . 63.34 111.432 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.73 -33.1 64.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 62.45 110.992 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.73 -38.64 11.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.171 0.51 . . . . 75.43 110.489 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.593 ' HB3' HD12 ' A' ' 84' ' ' LEU . 36.2 m -147.34 113.78 5.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.827 -0.624 . . . . 72.21 109.983 -177.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.84 128.54 33.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.025 0.441 . . . . 75.22 110.983 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.572 ' HB3' HD21 ' A' ' 84' ' ' LEU . 3.9 p90 -136.61 21.94 3.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.635 -0.711 . . . . 70.54 110.651 177.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 58.51 -176.8 0.08 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.128 0.49 . . . . 64.05 110.576 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.7 tp -152.62 109.84 3.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.4 -0.363 . . . . 74.15 110.197 170.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.424 ' OE2' HD11 ' A' ' 42' ' ' ILE . 33.2 tt0 -121.31 118.73 30.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.046 -0.525 . . . . 64.53 109.593 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -106.9 112.31 39.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.612 -0.514 . . . . 64.43 109.612 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.424 HD11 ' OE2' ' A' ' 40' ' ' GLU . 65.9 mt -111.2 116.66 53.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.025 -0.534 . . . . 74.13 110.727 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.619 ' ND2' ' HA ' ' A' ' 16' ' ' GLU . 14.6 m120 -76.55 116.98 17.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.809 -0.632 . . . . 75.43 111.06 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.576 HD13 ' HA ' ' A' ' 51' ' ' THR . 17.9 pt -77.04 -38.65 28.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.965 -0.561 . . . . 74.45 109.83 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.1 t70 32.33 -96.42 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.575 1.172 . . . . 71.13 112.988 -177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.74 34.79 3.63 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.861 -0.685 . . . . 40.1 112.469 -177.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.18 116.81 23.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.584 -0.525 . . . . 72.14 109.584 176.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -57.01 -25.05 57.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.849 0.685 . . . . 55.21 112.849 -174.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -77.8 -58.09 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.354 -0.538 . . . . 73.23 110.768 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.5 mt -78.78 -39.58 35.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.61 0.596 . . . . 74.34 112.61 -172.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.576 ' HA ' HD13 ' A' ' 44' ' ' ILE . 87.9 m -60.69 -48.76 80.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.834 0.35 . . . . 73.14 110.966 -178.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -64.43 -29.39 70.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.916 0.389 . . . . 74.34 110.912 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.5 mt -80.09 -50.67 10.01 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.386 0.513 . . . . 75.3 112.386 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -109.04 -1.87 18.58 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.328 1.233 . . . . 74.14 114.328 -165.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -73.19 89.25 1.51 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.916 0.78 . . . . 72.21 112.004 -175.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -136.75 -85.42 0.33 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.308 -0.86 . . . . 72.34 109.177 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -139.59 81.44 1.83 Allowed 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 105.761 -1.941 . . . . 75.55 105.761 171.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.475 ' O ' HG22 ' A' ' 60' ' ' VAL . 0.1 OUTLIER -51.09 -84.86 0.0 OUTLIER Pre-proline 0 CA--C 1.507 -0.685 0 CA-C-N 114.435 -1.257 . . . . 63.51 114.365 -157.203 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.446 ' HD3' HG22 ' A' ' 58' ' ' VAL . 51.0 Cg_exo -21.08 78.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.569 0 C-N-CA 122.718 2.279 . . . . 74.43 114.223 -144.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.554 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -99.56 133.41 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.592 -0.731 . . . . 75.43 111.267 -170.374 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.701 HD23 HG23 ' A' ' 12' ' ' VAL . 58.1 mt -88.27 106.48 18.24 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.294 0.568 . . . . 74.13 109.694 170.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -91.31 121.97 33.52 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.309 -0.86 . . . . 74.24 109.868 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.5 100.89 6.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.85 -0.614 . . . . 70.32 110.465 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 52.8 t -67.89 161.57 3.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.315 -0.624 . . . . 75.44 109.315 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 79.68 -46.81 0.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.184 0.594 . . . . 74.23 111.618 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -94.3 -26.39 16.61 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.807 0.337 . . . . 73.53 110.258 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 60.99 82.21 0.17 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.316 -0.856 . . . . 72.51 111.791 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -165.11 166.41 19.13 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.261 -0.881 . . . . 74.0 110.112 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -94.17 127.98 40.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 72.44 110.393 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.4 mt -100.91 -82.19 0.46 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.537 0.684 . . . . 71.5 111.733 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 37.8 t -135.8 148.69 48.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.167 -0.924 . . . . 75.44 110.65 -169.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -145.2 163.19 35.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.74 -0.209 . . . . 75.14 111.236 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 82.85 -77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.616 0.969 . . . . 72.4 113.616 171.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -114.46 -0.35 13.78 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.737 0.643 . . . . 75.25 112.737 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.6 tp 66.93 108.27 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.673 . . . . 75.42 111.371 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -80.68 -21.8 40.99 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 54.12 110.8 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.7 m 70.82 -54.19 0.66 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.704 0.627 . . . . 75.33 111.809 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -60.39 -45.6 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.005 0.372 . . . . 74.52 112.005 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.13 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 75.44 111.977 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.812 HD12 HD22 ' A' ' 84' ' ' LEU . 5.5 tp -71.84 -34.53 51.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 C-N-CA 120.3 -0.56 . . . . 75.23 109.804 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.35 -35.25 90.69 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.649 -0.786 . . . . 74.32 111.731 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.32 72.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.984 0.421 . . . . 74.12 111.191 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.455 ' CZ ' ' HD3' ' A' ' 8' ' ' ARG . 20.2 t80 -87.76 -47.73 8.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.452 . . . . 75.12 111.712 178.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.812 HD22 HD12 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -69.46 -37.43 77.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.102 -0.499 . . . . 74.05 111.889 -171.396 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 110.487 -0.19 . . . . 75.31 110.487 -179.329 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.0 mtm . . . . . 0 N--CA 1.483 1.223 0 N-CA-C 109.661 -0.496 . . . . 73.25 109.661 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -74.2 49.15 0.34 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.405 0.621 . . . . 74.22 111.042 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -112.04 96.65 6.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.618 -0.719 . . . . 75.22 109.478 -177.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -70.45 122.87 20.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.032 0.92 . . . . 73.22 111.409 -175.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.1 m -124.61 119.72 56.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 114.631 -1.168 . . . . 64.43 108.98 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -129.89 153.67 80.98 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.129 -0.487 . . . . 72.54 110.935 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.35 152.9 61.35 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.871 2.381 . . . . 64.24 113.282 -173.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' ' O ' ' A' ' 85' ' ' SER . 2.4 ptp180 -115.24 150.04 36.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.264 -0.88 . . . . 74.23 108.64 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 47.1 mtpt -100.38 135.96 41.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.643 0.609 . . . . 75.45 112.643 -172.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 HD11 ' A' ' 80' ' ' ILE . 73.5 mt -103.63 130.52 51.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.372 -0.831 . . . . 73.13 110.038 170.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.573 HG21 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -107.9 128.64 63.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.981 -0.554 . . . . 72.35 110.445 175.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.504 HG22 HD21 ' A' ' 61' ' ' LEU . 86.2 t -96.46 119.5 44.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 109.106 -0.701 . . . . 74.43 109.106 174.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -78.47 97.02 5.55 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.015 0.436 . . . . 73.1 110.811 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.528 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -80.44 160.62 43.98 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.81 -0.71 . . . . 75.25 112.539 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.62 ' CB ' HG12 ' A' ' 58' ' ' VAL . 34.9 ttp180 -144.94 -0.67 0.89 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.077 -0.712 . . . . 74.14 109.077 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 59.18 170.66 0.07 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 114.731 -1.122 . . . . 71.1 111.033 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.23 -56.94 4.88 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.808 -0.711 . . . . 55.45 113.632 175.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.17 113.47 6.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.085 0.469 . . . . 73.22 110.97 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -71.46 -28.29 63.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.871 -0.604 . . . . 74.41 111.198 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.4 -30.19 51.36 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.624 0.231 . . . . 75.22 111.624 178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.416 ' O ' HG13 ' A' ' 25' ' ' ILE . 71.0 m -56.08 -38.74 71.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.671 0.272 . . . . 71.42 110.731 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -71.29 -33.46 69.75 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.731 0.3 . . . . 75.23 110.629 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -56.24 -45.05 80.17 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.081 -0.509 . . . . 75.22 110.077 175.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.604 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.7 mmm -67.0 -41.47 86.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.517 -0.765 . . . . 74.55 110.137 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 21' ' ' CYS . 79.1 mt -56.82 -45.26 83.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 115.938 -0.573 . . . . 71.05 110.805 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.45 87.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.903 0.382 . . . . 75.11 110.69 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -61.59 -42.86 99.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 54.2 110.958 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 24' ' ' MET . 73.8 mt -64.06 -37.6 88.04 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.209 -0.45 . . . . 75.2 110.915 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -61.24 -42.4 98.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.254 -0.43 . . . . 75.03 110.893 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 97.9 t -71.61 -39.43 69.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.622 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.425 HD22 ' HA ' ' A' ' 31' ' ' LEU . 14.2 mt -66.71 -34.79 78.62 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.377 -0.374 . . . . 75.31 111.443 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -59.87 -20.99 60.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 73.12 111.37 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -82.02 -15.86 52.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 74.22 111.191 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -106.43 -46.2 4.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.481 0.658 . . . . 71.33 109.743 178.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.523 ' HB3' HD11 ' A' ' 84' ' ' LEU . 50.9 m -141.19 113.22 7.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.884 -1.053 . . . . 72.15 109.319 -175.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -79.22 129.22 34.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.989 0.423 . . . . 64.52 111.7 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HB3' HD12 ' A' ' 84' ' ' LEU . 3.1 p90 -138.27 18.42 2.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.997 -0.547 . . . . 74.4 111.282 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 57.84 -178.55 0.06 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.329 0.585 . . . . 73.11 111.159 -176.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.8 tp -150.7 117.3 5.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.053 -0.521 . . . . 74.22 110.36 171.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.573 ' HB3' HG21 ' A' ' 11' ' ' VAL . 29.7 tt0 -126.47 123.51 38.0 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.557 -0.747 . . . . 71.3 109.568 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.1 t -104.74 120.25 54.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.472 -0.331 . . . . 62.23 110.153 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.492 HD13 HG11 ' A' ' 11' ' ' VAL . 75.7 mt -124.71 110.41 24.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.381 -0.372 . . . . 62.52 110.333 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.528 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.2 m120 -69.62 122.81 19.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.265 0.555 . . . . 75.23 111.829 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.403 HD12 ' HA ' ' A' ' 51' ' ' THR . 44.8 pt -86.57 -10.05 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.856 -0.611 . . . . 72.2 110.445 178.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.426 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 5.6 p-10 -73.53 -7.12 50.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.014 0.435 . . . . 74.53 110.32 177.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.36 -2.95 58.83 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.156 -0.778 . . . . 74.33 111.156 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -131.59 97.52 4.25 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.426 -0.583 . . . . 65.21 109.426 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.92 -24.67 67.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.307 0.855 . . . . 54.34 113.307 -169.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -75.27 -41.67 56.73 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.231 -0.588 . . . . 71.32 110.171 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.91 -31.5 72.7 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.51 -0.313 . . . . 75.5 110.594 173.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.403 ' HA ' HD12 ' A' ' 44' ' ' ILE . 45.5 m -53.43 -57.16 11.62 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.069 -0.514 . . . . 54.2 111.326 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.0 mtt-85 -63.93 -31.28 72.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.025 0.44 . . . . 71.23 111.62 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.7 mt -68.11 -39.86 82.69 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.333 0.494 . . . . 72.11 112.333 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -131.47 19.34 4.77 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 112.44 0.533 . . . . 75.42 112.44 -172.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -52.13 -53.35 43.8 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.051 0.453 . . . . 75.42 111.846 -176.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -93.25 11.88 26.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.749 -0.659 . . . . 72.5 110.365 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.734 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 72.7 mtm180 -135.49 50.82 2.1 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.773 -0.825 . . . . 75.33 108.773 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.62 HG12 ' CB ' ' A' ' 15' ' ' ARG . 1.4 m -89.27 -24.28 0.29 Allowed Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 114.078 1.14 . . . . 75.15 114.078 -178.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.466 ' HD3' HG21 ' A' ' 58' ' ' VAL . 8.3 Cg_exo -75.08 52.02 2.97 Favored 'Trans proline' 0 N--CA 1.44 -1.64 0 CA-C-N 121.025 1.402 . . . . 74.01 110.039 165.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.734 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.4 OUTLIER -111.46 150.53 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 CA-C-N 114.893 -1.049 . . . . 73.33 110.141 -171.048 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.504 HD21 HG22 ' A' ' 12' ' ' VAL . 91.6 mt -113.28 122.14 46.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.896 0.379 . . . . 73.53 111.18 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.542 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 91.2 t80 -99.61 125.26 45.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.965 -0.561 . . . . 73.51 109.931 175.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' HD22 ' A' ' 70' ' ' LEU . . . -84.88 106.95 16.78 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.895 0.379 . . . . 74.41 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 97.3 t -78.89 93.83 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.04 -0.527 . . . . 74.23 110.093 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 170.89 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 72.43 109.206 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -119.64 -11.63 9.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.596 -0.729 . . . . 74.12 111.026 -176.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 66.69 89.57 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.429 0.633 . . . . 75.44 109.725 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -167.9 150.57 5.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 75.15 109.913 -175.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.76 135.41 34.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.753 -0.462 . . . . 72.53 109.753 175.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 63' ' ' ALA . 3.1 mm? -79.14 -70.99 0.47 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.779 -0.646 . . . . 75.44 110.496 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.469 ' SG ' HD13 ' A' ' 75' ' ' LEU . 8.4 p -152.97 -178.91 7.21 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.388 -0.824 . . . . 73.21 110.101 -178.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -118.38 -170.93 1.98 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.851 -0.613 . . . . 61.44 110.242 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.429 ' HB3' ' CG ' ' A' ' 59' ' ' PRO . 21.1 p90 -41.9 135.16 2.43 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 123.769 0.668 . . . . 75.44 111.378 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 71.87 94.13 0.08 Allowed 'General case' 0 C--O 1.231 0.127 0 O-C-N 124.119 0.887 . . . . 73.3 109.353 -173.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.544 ' HA ' ' HE2' ' A' ' 24' ' ' MET . 38.4 tp -53.58 123.86 13.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.07 -1.423 . . . . 72.45 113.849 -166.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.9 94.24 6.45 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.081 -1.081 . . . . 72.11 108.081 167.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.1 m -67.85 -36.43 80.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 72.52 111.515 -169.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.55 -43.46 98.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.341 . . . . 61.55 111.228 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.2 -46.92 86.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.159 -0.473 . . . . 72.22 111.598 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.596 HD11 HD22 ' A' ' 84' ' ' LEU . 7.8 tp -66.93 -37.22 78.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.034 -0.666 . . . . 74.04 110.431 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.85 -37.2 93.31 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.578 -0.82 . . . . 61.3 111.661 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -47.46 83.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.879 0.371 . . . . 75.24 110.843 177.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -72.6 -34.25 67.27 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.002 -0.545 . . . . 74.52 111.767 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.596 HD22 HD11 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -84.41 11.05 9.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.409 -0.359 . . . . 75.45 111.859 -174.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.774 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.162 -0.681 . . . . 65.43 109.162 172.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.993 0.425 . . . . 74.54 110.454 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -123.76 -32.81 3.26 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.013 -0.539 . . . . 74.12 110.089 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -123.73 151.02 43.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.213 -0.448 . . . . 71.23 111.267 -177.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -123.46 156.39 35.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.854 -0.612 . . . . 54.41 109.48 175.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -99.89 178.58 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.175 0.512 . . . . 72.24 111.463 -177.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -112.96 168.16 8.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.0 -1.0 . . . . 74.3 109.324 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.8 154.51 48.73 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.057 1.838 . . . . 74.15 113.153 -174.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.899 ' NH1' ' O ' ' A' ' 85' ' ' SER . 9.5 ptp180 -109.54 116.22 31.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.746 -0.661 . . . . 73.15 109.602 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -74.78 140.12 43.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.877 0.695 . . . . 74.21 112.877 -168.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 HD13 ' A' ' 80' ' ' ILE . 32.8 mt -113.08 145.89 40.12 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.203 -0.908 . . . . 74.34 110.736 172.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.546 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.9 t -119.73 138.53 50.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.004 -0.544 . . . . 71.31 109.937 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.693 HG22 HD21 ' A' ' 61' ' ' LEU . 65.9 t -113.57 119.97 62.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 N-CA-C 110.165 -0.309 . . . . 74.43 110.165 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CB ' HG22 ' A' ' 60' ' ' VAL . 63.8 m-85 -83.64 113.87 21.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.526 -0.546 . . . . 75.31 109.526 174.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -124.01 -173.74 13.97 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.617 -0.593 . . . . 74.22 111.617 -177.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.2 ptm85 -159.2 154.89 26.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.821 0.343 . . . . 74.31 110.715 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -73.44 72.62 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.541 -0.754 . . . . 71.12 109.686 174.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.56 61.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.672 -0.695 . . . . 73.45 111.926 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.4 t -172.06 114.37 0.33 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.889 -0.782 . . . . 63.43 108.889 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -70.99 -35.46 72.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.345 -0.389 . . . . 65.14 111.826 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 20' ' ' LEU . 37.1 mt -52.95 -29.2 27.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.929 0.714 . . . . 70.23 112.929 -172.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 62.6 m -54.99 -32.93 62.12 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.623 0.249 . . . . 73.02 111.045 178.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -64.15 -50.34 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.381 -0.372 . . . . 63.24 110.401 178.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -55.12 -49.44 71.75 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.518 -0.764 . . . . 54.15 111.241 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.524 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 63.7 mtp -59.09 -54.28 48.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 71.14 111.115 -179.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 84.1 mt -56.12 -50.59 69.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 73.52 111.407 -177.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -37.81 73.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.958 0.409 . . . . 72.42 111.142 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.4 m -69.11 -43.48 74.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 65.54 110.879 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 24' ' ' MET . 80.4 mt -65.38 -38.38 89.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.03 111.424 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -58.07 -35.65 71.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 74.32 111.01 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.7 t -77.32 -32.71 19.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.328 -0.396 . . . . 75.3 110.608 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -30.68 66.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.037 0.446 . . . . 75.23 109.859 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.6 mt-30 -59.93 -20.83 59.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.88 -0.6 . . . . 71.41 111.252 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -81.21 -15.54 55.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 74.31 110.855 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -96.97 -49.29 5.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.319 -0.623 . . . . 65.32 109.319 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 17.9 m -140.88 119.8 12.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.025 -0.989 . . . . 72.34 109.366 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -79.26 131.68 36.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.039 0.447 . . . . 74.44 110.618 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.524 ' CD1' HD13 ' A' ' 10' ' ' LEU . 9.1 p90 -139.15 16.58 2.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.806 -0.634 . . . . 75.22 111.582 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 59.94 178.5 0.09 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.991 0.424 . . . . 72.24 110.611 -176.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.9 tp -153.19 110.12 3.45 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 120.264 -0.574 . . . . 72.43 110.88 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -115.87 118.63 33.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.97 -0.559 . . . . 72.43 109.97 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -105.4 113.84 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 110.085 -0.339 . . . . 65.02 110.085 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.7 mt -113.05 114.85 48.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.148 -0.478 . . . . 74.44 110.869 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -73.04 118.24 15.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.659 -0.701 . . . . 72.53 111.509 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 50' ' ' LEU . 28.9 pt -86.11 -25.27 6.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.07 -0.514 . . . . 73.33 111.804 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -67.49 -23.51 65.49 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.978 0.418 . . . . 74.02 111.55 -172.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.89 19.38 30.11 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.993 -0.622 . . . . 74.24 111.828 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -142.27 119.39 11.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.378 -0.601 . . . . 63.44 109.378 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -55.52 -37.52 68.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 74.22 111.26 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.51 -52.75 9.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.158 -0.473 . . . . 65.13 110.966 -174.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.417 HD21 HD13 ' A' ' 53' ' ' LEU . 48.4 mt -64.11 -33.73 76.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.519 -0.31 . . . . 71.43 111.573 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.1 m -57.85 -53.21 60.77 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 120.845 0.355 . . . . 64.54 110.368 175.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.88 -31.48 72.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.27 -0.423 . . . . 74.31 111.402 -178.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.417 HD13 HD21 ' A' ' 50' ' ' LEU . 72.1 mt -71.55 -48.35 49.08 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.381 0.512 . . . . 74.43 112.381 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.537 ' CD2' HG21 ' A' ' 60' ' ' VAL . 89.6 m-85 -113.94 8.59 17.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.28 0.844 . . . . 75.32 113.28 -169.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -59.66 135.86 57.81 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.398 -0.521 . . . . 75.04 111.478 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.3 t70 74.86 -30.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 71.44 112.903 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -116.03 37.24 3.73 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 108.364 -0.976 . . . . 75.15 108.364 -175.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.573 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.67 -97.57 0.0 OUTLIER Pre-proline 0 N--CA 1.425 -1.717 0 CA-C-N 115.276 -0.875 . . . . 74.5 110.228 -176.228 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.573 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 65.8 Cg_exo -17.74 75.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 122.535 2.157 . . . . 72.14 113.288 -146.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.548 HG13 ' O ' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -111.3 126.16 68.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.916 -1.038 . . . . 70.42 111.699 -165.546 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.693 HD21 HG22 ' A' ' 12' ' ' VAL . 21.5 mt -89.62 112.87 24.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.882 -0.599 . . . . 75.21 110.72 176.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.58 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.0 t80 -91.79 120.28 32.37 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.522 -0.763 . . . . 72.15 109.761 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.87 102.82 11.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.945 -0.57 . . . . 72.21 110.196 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 50.0 t -63.94 146.83 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.145 -0.687 . . . . 64.34 109.145 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 85.18 -29.06 0.08 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.157 0.983 . . . . 75.05 111.047 -177.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.681 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 28.0 mt-10 -96.7 -37.01 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.26 -0.176 . . . . 74.51 111.236 176.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 18.2 t70 68.93 77.77 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.791 0.682 . . . . 75.35 109.896 -176.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.681 ' HD3' ' HB3' ' A' ' 66' ' ' GLU . 16.4 ptmt -179.77 157.82 0.75 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.36 -0.837 . . . . 73.14 109.674 -174.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mp0 -94.9 141.19 28.93 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.566 -0.531 . . . . 74.55 109.566 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 63.4 mt -84.07 -66.16 0.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.447 0.642 . . . . 74.34 110.036 176.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 19.3 t -144.29 170.76 15.39 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.865 -0.791 . . . . 74.51 108.865 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.532 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 1.5 p-80 -144.36 174.65 10.73 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 123.006 0.191 . . . . 74.54 111.503 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 80.05 -81.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.173 0.989 . . . . 74.25 112.256 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -112.37 -84.5 0.58 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 121.023 -0.271 . . . . 62.33 110.846 -173.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.4 tp 178.35 147.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.126 -0.488 . . . . 72.21 110.016 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.516 ' O ' HG21 ' A' ' 80' ' ' ILE . 18.6 t70 -141.12 109.74 5.99 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.498 -0.556 . . . . 73.44 109.498 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 -27.88 69.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.829 -0.623 . . . . 72.43 111.659 -174.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -73.84 -49.53 24.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.967 -0.56 . . . . 65.24 111.446 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.21 -46.97 89.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 74.53 111.796 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.719 HD13 HD23 ' A' ' 84' ' ' LEU . 7.0 tp -69.42 -30.5 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.856 -0.737 . . . . 72.15 109.985 177.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -19.97 67.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.047 -0.597 . . . . 53.22 111.8 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.79 -35.21 60.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.127 0.489 . . . . 64.33 110.231 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -86.53 -40.12 15.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 74.02 111.057 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.719 HD23 HD13 ' A' ' 80' ' ' ILE . 1.7 mm? -85.74 13.51 7.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.4 -0.363 . . . . 71.14 111.404 -178.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.899 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 4.4 t . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.502 -0.555 . . . . 75.31 109.502 176.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.815 0.341 . . . . 61.4 110.339 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -145.34 116.86 8.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.299 -0.63 . . . . 74.2 109.299 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -122.72 132.42 54.24 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.882 0.372 . . . . 75.03 110.558 -178.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -132.53 161.32 34.1 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.522 -0.547 . . . . 75.42 109.522 179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.6 m -92.88 178.36 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.115 0.483 . . . . 75.42 110.255 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -105.11 156.97 35.29 Favored Pre-proline 0 C--N 1.316 -0.861 0 CA-C-N 115.755 -0.657 . . . . 74.23 109.911 179.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.99 121.28 4.43 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.632 2.221 . . . . 62.34 112.477 -175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -102.99 119.08 38.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.426 -0.806 . . . . 73.51 109.741 177.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 57.6 mtpt -73.03 139.0 46.29 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.992 -0.549 . . . . 74.02 112.239 -172.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.53 HD11 HD12 ' A' ' 80' ' ' ILE . 22.3 mt -105.77 119.12 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.286 -0.87 . . . . 72.12 109.923 170.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.575 HG22 ' HB3' ' A' ' 40' ' ' GLU . 80.9 t -102.07 129.89 52.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.868 -0.605 . . . . 74.43 109.982 177.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.527 HG23 ' CD2' ' A' ' 61' ' ' LEU . 46.3 t -96.33 107.06 19.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 116.068 -0.515 . . . . 75.53 109.731 176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.594 ' CB ' HG22 ' A' ' 60' ' ' VAL . 20.2 m-85 -81.48 116.89 21.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.396 -0.594 . . . . 75.43 109.396 174.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -147.93 -151.8 5.53 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.286 -0.726 . . . . 63.52 111.286 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.4 ptm180 -171.26 164.64 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.96 0.41 . . . . 73.4 110.743 176.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.13 131.09 48.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.531 -0.759 . . . . 74.41 110.704 175.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.81 -7.55 55.44 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 45.1 112.863 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -104.53 102.87 12.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.123 0.487 . . . . 73.12 109.827 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -64.61 -33.11 75.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.717 -0.674 . . . . 74.32 110.634 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -59.31 -31.57 69.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.389 -0.369 . . . . 71.32 111.56 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.466 ' O ' HG13 ' A' ' 25' ' ' ILE . 68.3 m -61.04 -42.04 97.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.977 0.418 . . . . 64.32 110.32 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -70.53 -35.13 72.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.02 -0.536 . . . . 71.45 110.47 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.49 -34.34 77.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.733 -0.667 . . . . 73.35 110.686 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.1 mtt -64.54 -43.97 92.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.098 -0.501 . . . . 73.35 110.893 173.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.6 mt -54.68 -53.25 33.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.315 -0.402 . . . . 75.54 110.92 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.18 -31.07 68.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.444 -0.344 . . . . 74.1 111.416 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.7 m -73.33 -46.24 50.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.216 -0.447 . . . . 72.11 110.721 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.467 HD12 HD12 ' A' ' 61' ' ' LEU . 9.2 mp -64.94 -35.91 82.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.197 -0.456 . . . . 75.03 111.604 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -56.61 -34.06 66.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.013 0.435 . . . . 75.32 111.257 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 77.7 t -76.79 -40.23 31.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.086 -0.506 . . . . 73.23 110.748 178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.453 HD22 ' HA ' ' A' ' 31' ' ' LEU . 10.5 mt -62.81 -34.71 77.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.525 -0.307 . . . . 75.04 111.024 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -53.93 -29.34 41.86 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.49 0.494 . . . . 72.11 111.444 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -77.23 -11.76 59.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.888 -0.596 . . . . 75.34 111.391 -176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -108.81 -45.84 3.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.527 0.68 . . . . 72.11 109.496 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.518 ' HB3' HD11 ' A' ' 84' ' ' LEU . 44.4 m -137.39 124.08 21.08 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.02 -0.991 . . . . 74.52 109.629 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -84.23 134.25 34.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.065 0.459 . . . . 75.43 111.597 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 9.5 p90 -147.79 18.23 1.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.769 -0.651 . . . . 73.51 110.957 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 58.53 -169.26 0.13 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.561 -0.29 . . . . 72.44 110.468 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.62 131.03 13.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.796 -0.446 . . . . 61.12 109.796 175.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HB3' HG22 ' A' ' 11' ' ' VAL . 5.1 tt0 -146.36 128.23 15.4 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.565 -0.532 . . . . 72.33 109.565 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.2 t -118.9 119.39 60.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.892 -0.41 . . . . 71.34 109.892 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 71.3 mt -127.7 126.15 66.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.466 -0.334 . . . . 74.03 110.971 -174.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 94.8 m-20 -76.98 126.95 31.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.591 . . . . 71.4 111.094 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.7 pp -79.06 -23.64 12.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 74.52 111.52 -178.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -79.17 -5.48 54.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 74.13 111.067 -175.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.69 -6.58 63.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.791 -0.719 . . . . 71.04 111.762 174.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -127.19 123.92 37.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.653 0.263 . . . . 75.45 110.85 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -50.92 -47.37 60.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 71.22 111.492 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -61.12 -48.88 79.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.386 . . . . 75.5 110.818 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.0 mt -73.23 -31.38 64.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.964 -0.562 . . . . 70.01 111.694 -172.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.656 ' O ' ' HB3' ' A' ' 55' ' ' ASN . 31.1 m -61.26 -51.69 67.89 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 121.16 0.505 . . . . 73.34 110.334 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -61.11 -30.74 70.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.916 -0.584 . . . . 71.22 111.112 -177.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.77 -34.27 24.82 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.034 0.753 . . . . 72.52 113.034 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -135.85 10.97 3.38 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.443 -0.503 . . . . 75.01 112.283 -165.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.656 ' HB3' ' O ' ' A' ' 51' ' ' THR . 2.7 p-10 -46.07 -39.09 8.81 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.251 0.834 . . . . 70.12 113.251 -172.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -131.0 21.6 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.641 0.734 . . . . 73.24 110.932 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.1 ttm180 -146.17 44.4 1.24 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.528 -1.286 . . . . 73.32 107.528 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.533 ' O ' HG11 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -78.2 -98.1 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.52 0 CA-C-N 115.199 -0.91 . . . . 73.24 111.275 -171.885 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.693 ' O ' ' HA ' ' A' ' 72' ' ' HIS . 73.0 Cg_exo -20.17 76.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.29 0 C-N-CA 122.504 2.136 . . . . 74.15 113.646 -145.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.594 HG22 ' CB ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -110.42 121.28 62.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 115.24 -0.891 . . . . 71.04 111.179 -170.521 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.527 ' CD2' HG23 ' A' ' 12' ' ' VAL . 38.9 mt -83.25 107.55 15.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.15 -0.477 . . . . 71.2 110.742 176.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -92.33 122.54 34.89 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.829 -0.623 . . . . 71.43 110.418 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.08 102.35 10.96 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.728 -0.669 . . . . 61.42 111.208 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.15 87.29 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.306 0.574 . . . . 73.43 110.184 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 172.32 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.764 -1.107 . . . . 75.12 108.233 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -99.15 -19.54 17.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.879 -1.055 . . . . 75.13 109.862 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.7 t70 67.37 78.41 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.122 -0.945 . . . . 72.12 111.029 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.98 149.32 0.9 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.042 -0.526 . . . . 73.53 110.445 174.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.57 140.09 34.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.941 -0.572 . . . . 75.24 110.415 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -91.6 -81.63 0.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.02 0.438 . . . . 75.32 110.838 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.4 p -122.82 164.45 18.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.113 -0.494 . . . . 73.4 109.85 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.693 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.4 p-80 -144.83 168.03 21.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.43 0.53 . . . . 62.23 112.43 -176.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 74.74 -82.5 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.241 1.016 . . . . 75.33 112.231 -179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -99.48 -79.51 0.49 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.77 -0.372 . . . . 75.14 110.512 -176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HA ' HD12 ' A' ' 75' ' ' LEU . 22.2 tp 171.21 147.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.888 0.743 . . . . 65.44 109.716 176.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -123.68 115.37 21.32 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.675 -0.861 . . . . 73.14 108.675 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.7 p -82.04 -2.63 52.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.981 -0.554 . . . . 74.22 112.364 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -107.43 -39.45 5.64 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.94 -0.304 . . . . 74.44 111.092 -176.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.72 -45.04 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.601 -0.272 . . . . 75.43 110.69 176.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.53 HD12 HD11 ' A' ' 10' ' ' LEU . 7.3 tp -68.34 -31.47 51.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.532 -0.467 . . . . 74.44 110.09 176.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.12 -34.51 86.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.646 -0.788 . . . . 75.41 111.704 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.95 -36.7 72.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.987 0.422 . . . . 63.33 110.492 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -81.34 -47.25 13.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.898 -0.592 . . . . 71.23 111.837 -177.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.525 HD23 HD12 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -79.11 13.41 1.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.08 0.4 . . . . 74.13 112.08 -172.045 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.765 -0.457 . . . . 65.14 109.765 176.536 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 N--CA 1.449 -0.511 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -81.39 173.95 11.09 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.786 2.324 . . . . 0.0 113.044 -171.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -103.75 140.47 37.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.562 ' HD3' ' HB2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -86.66 146.96 26.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 -176.324 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 61' ' ' LEU . 96.3 mt -122.16 137.65 54.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.355 0.598 . . . . 0.0 111.216 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.531 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -119.35 139.62 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.144 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 53.0 t -110.89 114.01 45.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 120.923 0.392 . . . . 0.0 110.133 175.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.761 ' HB2' HG23 ' A' ' 60' ' ' VAL . 71.5 m-85 -82.31 132.57 35.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.165 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.61 -163.58 13.56 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -157.47 121.37 4.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.93 -171.39 0.16 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.475 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.16 98.14 2.21 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.23 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.448 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 38.8 t -108.1 142.36 38.41 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 3.4 m170 -60.28 -44.44 95.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 73' ' ' TYR . 45.0 mt -58.43 -35.18 71.7 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.184 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.505 ' O ' HG13 ' A' ' 25' ' ' ILE . 77.9 m -62.51 -49.99 73.17 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 175.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.65 -44.11 93.67 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.326 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.3 mm-40 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.684 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.413 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.1 mtp -69.09 -37.95 78.7 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.918 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 21' ' ' CYS . 71.5 mt -56.91 -48.92 80.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 175.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -59.53 -41.17 89.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.651 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.7 m -61.42 -46.7 89.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.899 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.486 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 93.2 mt -72.61 -31.31 65.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.381 -177.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -63.61 -39.02 93.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.921 0.391 . . . . 0.0 110.393 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.421 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 91.7 t -65.95 -44.9 92.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.31 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 31' ' ' LEU . 11.9 mt -62.73 -35.6 80.27 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.527 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.697 HE22 ' HB2' ' A' ' 39' ' ' LEU . 40.0 mt-30 -58.68 -21.38 54.27 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -74.69 -30.91 61.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.026 0.441 . . . . 0.0 110.738 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -91.17 -46.52 8.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.095 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.602 ' HB3' HD12 ' A' ' 84' ' ' LEU . 23.2 m -138.5 115.86 11.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.66 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -78.59 131.9 36.92 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.538 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.523 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 3.6 p90 -145.46 13.8 1.39 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.562 ' HB2' ' HD3' ' A' ' 9' ' ' LYS . 15.7 mt-10 57.64 179.86 0.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.516 -175.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HB2' HE22 ' A' ' 32' ' ' GLN . 8.3 tp -152.02 114.74 4.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' HG22 ' A' ' 11' ' ' VAL . 13.2 tt0 -129.64 120.34 25.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.309 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.3 116.86 45.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.954 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.419 HD12 HG11 ' A' ' 11' ' ' VAL . 68.5 mt -114.22 130.15 68.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -175.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -74.98 119.53 19.28 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.623 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.6 pt -88.12 -15.52 9.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.118 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -54.81 -37.26 65.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.372 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.94 -51.12 15.72 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.978 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -82.01 93.81 7.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.018 0.437 . . . . 0.0 110.739 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.91 -18.94 65.67 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.257 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.56 -43.42 98.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 171.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.71 -36.93 73.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.296 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.532 ' HA ' HD12 ' A' ' 44' ' ' ILE . 92.0 m -64.35 -34.85 79.1 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.582 176.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.3 -35.71 81.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.157 0.503 . . . . 0.0 109.866 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.61 -51.02 21.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.399 178.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -108.65 -64.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.888 -170.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 51' ' ' THR . 7.2 t30 55.37 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.349 0.66 . . . . 0.0 112.152 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -84.07 -29.27 26.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 -174.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HD2' ' N ' ' A' ' 57' ' ' ARG . 1.1 mpt_? -95.26 66.87 2.94 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.694 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -85.73 -122.71 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.632 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.751 179.059 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.694 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 88.3 Cg_exo -10.33 66.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.449 2.1 . . . . 0.0 113.409 -142.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.71 127.0 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.971 -167.948 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 10' ' ' LEU . 2.4 tm? -91.17 103.7 16.35 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.385 -177.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.492 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 79.2 t80 -95.57 136.89 35.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.754 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.54 109.3 20.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 21.4 t -85.72 153.69 3.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 2.6 m-20 71.71 22.09 4.1 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -173.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -157.44 -39.38 0.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.072 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 69.96 60.15 0.26 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.245 172.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.58 158.67 37.52 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.022 176.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -82.93 139.09 33.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.0 mt -105.23 -64.52 1.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.444 0.64 . . . . 0.0 110.09 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 71.0 m -132.14 -177.11 4.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.333 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.612 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 10.9 p80 -144.41 -170.32 3.34 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.784 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.3 p90 -39.67 134.05 1.4 Allowed 'General case' 0 C--O 1.238 0.492 0 O-C-N 124.081 0.863 . . . . 0.0 111.073 175.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.49 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 88.1 m-85 73.31 95.76 0.07 Allowed 'General case' 0 N--CA 1.464 0.229 0 O-C-N 124.474 1.109 . . . . 0.0 109.426 -171.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.5 tp -60.31 128.6 37.51 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.443 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -78.84 -32.71 46.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.1 m 69.98 -51.25 0.64 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.281 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -56.38 -48.04 77.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.986 0.422 . . . . 0.0 111.574 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 33.8 t -64.25 -51.67 65.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.369 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.97 -25.87 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.513 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.647 ' O ' ' O ' ' A' ' 85' ' ' SER . . . -64.35 -44.69 95.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.417 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.94 -24.49 65.19 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.241 0.544 . . . . 0.0 110.818 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -87.9 -57.05 3.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.163 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -71.94 -39.79 69.18 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.7 -170.506 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.647 ' O ' ' O ' ' A' ' 81' ' ' GLY . 32.6 t . . . . . 0 C--N 1.324 -0.524 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -174.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.565 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 11.7 pt-20 . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 110.141 -0.318 . . . . 72.51 110.141 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.1 Cg_endo -73.07 143.42 36.05 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.107 1.871 . . . . 72.33 111.839 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 1.001 ' NH1' ' O ' ' A' ' 85' ' ' SER . 10.8 ptp180 -97.73 171.39 8.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.761 -0.654 . . . . 65.23 109.751 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.573 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.4 tttt -135.79 152.78 51.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.048 0.452 . . . . 75.31 111.748 -174.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.642 HD13 HD11 ' A' ' 61' ' ' LEU . 95.4 mt -122.58 147.52 46.3 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.38 -0.827 . . . . 72.5 110.838 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' A' ' 64' ' ' VAL . 78.0 t -122.91 133.56 68.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.864 -0.607 . . . . 70.22 110.17 175.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 61' ' ' LEU . 72.6 t -105.37 114.32 44.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 120.941 0.4 . . . . 65.15 110.304 175.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.11 117.88 29.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.937 -0.574 . . . . 75.32 110.074 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.451 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.28 163.91 26.66 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.271 -0.966 . . . . 74.15 112.56 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.998 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.3 ptm180 -150.29 114.31 5.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.252 -0.277 . . . . 53.13 110.252 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.68 17.93 4.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.715 -0.675 . . . . 71.04 112.549 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.58 64.92 0.36 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.071 -0.585 . . . . 61.3 111.76 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 46.1 t -60.16 -47.68 84.91 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.437 0.295 . . . . 21.41 111.478 -175.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.565 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 t-160 -68.54 -47.25 67.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.519 -0.31 . . . . 71.11 110.546 -175.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -63.12 -36.08 82.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.323 -0.399 . . . . 70.31 111.001 -179.743 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.72 -47.8 82.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 63.3 110.14 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 27.5 mm-40 -56.88 -43.88 81.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.151 -0.477 . . . . 62.15 111.297 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.9 mm-40 -62.96 -48.18 79.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.882 -0.599 . . . . 74.33 110.989 -177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 81.3 mtp -67.46 -38.69 84.83 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.872 -0.331 . . . . 72.21 111.153 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 44.4 mt -57.46 -44.48 84.76 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.516 -0.179 . . . . 72.22 110.516 178.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.12 -43.34 82.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.891 0.377 . . . . 73.01 110.683 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -63.21 -43.33 98.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.051 177.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' MET . 92.7 mt -69.72 -34.36 73.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.932 -0.576 . . . . 74.12 111.112 -178.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 24.2 mmm-85 -60.67 -38.94 86.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.06 0.457 . . . . 74.45 110.576 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.585 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.1 t -70.13 -43.83 78.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.853 -0.612 . . . . 73.42 110.638 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -33.23 74.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.378 -0.374 . . . . 62.4 110.741 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -59.93 -23.92 63.92 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.746 0.308 . . . . 64.44 111.529 176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.1 mtmt -76.68 -17.69 58.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.103 0.478 . . . . 51.31 110.996 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -103.69 -43.14 5.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.699 -0.682 . . . . 72.2 110.423 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.563 ' HB3' HD12 ' A' ' 84' ' ' LEU . 20.0 m -142.94 119.88 11.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.217 -0.901 . . . . 43.42 109.452 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -78.22 131.77 37.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.345 . . . . 75.34 110.913 -177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.605 ' CD1' HD12 ' A' ' 10' ' ' LEU . 6.7 p90 -144.82 16.66 1.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.905 -0.588 . . . . 75.04 111.482 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 36.8 mm-40 58.58 -175.32 0.09 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 73.32 110.974 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.7 tp -151.58 110.71 3.9 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 122.001 -0.437 . . . . 62.32 110.692 172.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . 9.4 tp10 -104.62 141.16 36.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.043 -0.526 . . . . 74.04 109.912 176.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.4 t -127.89 117.29 45.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.454 -0.573 . . . . 71.01 109.454 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.4 mt -128.65 110.62 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.429 . . . . 60.45 111.657 -176.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.4 m120 -68.54 107.41 2.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.896 -0.593 . . . . 54.11 110.007 171.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.433 ' CD1' ' HB2' ' A' ' 54' ' ' TYR . 44.5 pt -82.79 -7.52 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.09 -0.505 . . . . 70.33 111.089 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -59.13 -35.62 73.79 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.429 0.456 . . . . 64.33 111.031 -174.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -82.22 -12.38 80.85 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.574 -0.822 . . . . 74.05 112.873 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -103.9 110.14 22.16 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.073 0.464 . . . . 75.11 110.323 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 15.3 tm-20 -59.08 -44.36 91.87 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.48 -0.782 . . . . 71.32 111.12 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -69.37 -34.96 75.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.578 -0.283 . . . . 73.03 111.442 -175.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.19 -34.71 66.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.88 0.372 . . . . 70.23 110.603 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.53 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 67.7 m -63.35 -31.19 72.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 73.35 110.702 178.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.0 mmm-85 -57.67 -35.8 71.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.368 0.604 . . . . 74.23 110.823 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.8 mt -89.54 -50.14 6.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.498 -0.773 . . . . 64.2 112.401 -175.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.562 ' O ' HG13 ' A' ' 58' ' ' VAL . 20.0 m-85 -108.82 3.97 23.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.332 0.864 . . . . 73.3 113.332 -165.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 51' ' ' THR . 10.4 t30 -43.2 -56.75 3.29 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.237 0.828 . . . . 71.32 113.237 -174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -98.18 1.46 47.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.002 0.371 . . . . 74.3 112.002 -173.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.449 ' O ' HG22 ' A' ' 60' ' ' VAL . 96.5 mtt180 -132.96 55.12 1.91 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 75.51 108.897 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.998 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -80.37 -135.07 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 118.825 -0.607 . . . . 74.24 111.978 -172.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.785 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 39.5 Cg_exo -5.45 68.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.476 0 C-N-CA 122.73 2.287 . . . . 64.13 113.474 -139.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -91.09 127.21 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 CA-C-N 115.649 -0.705 . . . . 64.13 110.104 -171.143 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 10' ' ' LEU . 2.7 tm? -93.0 107.3 19.11 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.675 -0.693 . . . . 72.02 109.577 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.502 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 83.6 t80 -98.71 138.22 36.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.077 -0.965 . . . . 65.51 111.305 -173.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.01 112.08 21.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.854 -0.612 . . . . 73.41 110.561 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.574 ' CG2' HG23 ' A' ' 11' ' ' VAL . 38.4 t -73.64 155.0 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.076 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 86.2 m-20 79.02 -49.0 0.43 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.913 0.885 . . . . 65.24 111.718 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -87.88 -20.45 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.734 0.302 . . . . 64.14 110.778 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.502 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 m-20 63.02 82.18 0.19 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.857 -0.611 . . . . 72.13 112.305 175.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? -167.17 139.91 3.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.641 -0.709 . . . . 64.13 110.19 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.34 126.2 30.56 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.153 -0.684 . . . . 72.45 109.153 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB3' HG12 ' A' ' 79' ' ' VAL . 83.6 mt -94.76 -79.21 0.43 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.397 0.618 . . . . 74.21 110.644 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 79' ' ' VAL . 67.3 m -107.78 177.28 4.87 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.358 -0.837 . . . . 71.52 110.281 -175.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 6.6 p80 -131.78 -170.84 2.47 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.298 -0.63 . . . . 74.0 109.298 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.462 ' HD2' ' HD2' ' A' ' 74' ' ' PHE . 34.4 p90 -44.54 132.65 6.12 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 123.737 0.648 . . . . 74.33 110.204 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.462 ' HD2' ' HD2' ' A' ' 73' ' ' TYR . 93.1 m-85 70.78 103.35 0.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 O-C-N 124.026 0.829 . . . . 72.24 109.673 -171.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.5 tp -53.77 121.71 8.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.157 -0.929 . . . . 63.32 111.789 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.414 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 16.4 m-20 -76.83 -22.78 53.09 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.993 -0.549 . . . . 72.3 110.264 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 71.27 -60.4 0.52 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.929 0.892 . . . . 73.52 112.923 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -57.33 -43.77 83.67 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.893 0.378 . . . . 63.31 111.427 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.484 ' HB ' ' SG ' ' A' ' 71' ' ' CYS . 83.5 t -66.61 -42.1 89.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.922 -0.581 . . . . 74.32 111.852 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -71.69 -36.25 58.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 120.085 -0.646 . . . . 64.23 110.244 177.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -58.9 -36.07 85.91 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.469 -0.872 . . . . 43.42 111.39 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.529 0.332 . . . . 50.14 111.265 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -88.08 -36.38 16.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.954 0.407 . . . . 74.23 111.306 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.732 HD23 HD11 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -81.52 14.31 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 72.13 111.914 -175.749 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . 1.001 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 30.7 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.132 -0.485 . . . . 73.14 109.801 174.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 . . . . . 0 N--CA 1.448 -0.567 0 CA-C-O 120.766 0.317 . . . . 51.12 110.33 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.84 -179.77 5.07 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.925 2.417 . . . . 72.11 111.722 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HB3' ' OH ' ' A' ' 83' ' ' TYR . 25.9 mmt180 -97.07 -42.64 7.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.089 -0.505 . . . . 74.12 110.18 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.627 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.2 tmtp? 72.03 113.66 0.06 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.011 -0.995 . . . . 70.14 110.873 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.48 HD11 HD11 ' A' ' 80' ' ' ILE . 44.7 mt -106.86 131.56 53.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.509 -0.769 . . . . 73.12 111.014 177.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.4 t -106.79 130.2 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 75.41 109.68 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 61' ' ' LEU . 46.5 t -108.46 108.13 24.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 116.006 -0.543 . . . . 74.2 109.816 177.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.921 ' HB2' HG23 ' A' ' 60' ' ' VAL . 79.2 m-85 -76.22 118.25 18.75 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.965 -0.754 . . . . 72.41 108.965 175.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.87 -161.98 8.98 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.519 -0.848 . . . . 71.4 112.18 -176.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -162.65 -176.52 5.04 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.455 -0.572 . . . . 72.14 109.455 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.25 108.89 2.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.541 -0.3 . . . . 42.01 110.535 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 -144.93 16.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 121.087 -0.578 . . . . 73.22 112.067 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.8 m 70.69 95.76 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.056 0.542 . . . . 63.21 111.883 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.78 -39.59 81.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.633 -0.712 . . . . 72.31 109.897 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.545 HD23 ' OE2' ' A' ' 23' ' ' GLU . 64.6 mt -62.97 -30.94 71.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 73.31 111.794 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.89 -44.28 91.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 62.2 110.561 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -61.71 -43.01 99.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 60.05 110.279 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.545 ' OE2' HD23 ' A' ' 20' ' ' LEU . 39.0 mt-10 -66.0 -39.37 90.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.502 -0.772 . . . . 75.21 110.836 -178.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.422 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 11.6 mtt -61.25 -50.46 72.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 51.24 111.119 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.2 mt -57.21 -46.56 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.374 -0.376 . . . . 64.32 111.19 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.69 -32.58 73.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.914 0.388 . . . . 70.15 111.158 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -72.66 -45.52 58.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.765 -0.652 . . . . 54.44 110.875 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 24' ' ' MET . 96.9 mt -66.39 -32.37 73.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.927 -0.579 . . . . 64.13 111.233 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -56.73 -42.55 79.45 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.959 0.409 . . . . 70.53 110.91 176.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 61.4 t -67.14 -40.63 85.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.901 -0.591 . . . . 62.55 110.998 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.1 mt -70.06 -33.47 71.97 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.013 -0.275 . . . . 74.51 111.479 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -58.75 -21.15 54.73 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.853 0.359 . . . . 75.44 111.327 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.5 mtmt -77.98 -15.48 58.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.423 . . . . 70.54 111.653 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.1 -43.91 4.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.542 0.687 . . . . 73.44 109.445 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.548 ' HB3' HD12 ' A' ' 84' ' ' LEU . 47.3 m -138.51 109.14 6.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.234 -0.894 . . . . 71.43 109.928 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -73.0 126.08 29.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.089 0.471 . . . . 74.33 110.963 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.627 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 4.7 p90 -136.04 18.75 3.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.022 -0.535 . . . . 72.53 111.368 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 59.92 175.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.532 0.682 . . . . 54.02 111.302 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.5 tp -151.26 109.79 3.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.009 -0.541 . . . . 74.12 110.606 173.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -121.22 117.79 27.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 54.24 109.868 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.55 115.26 48.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 109.764 -0.458 . . . . 75.45 109.764 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.2 mt -114.59 122.27 68.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.244 -0.435 . . . . 72.22 111.071 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.46 111.36 4.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.794 -0.639 . . . . 70.44 111.275 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.4 pt -81.0 -21.62 11.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.865 -0.421 . . . . 73.15 109.865 176.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -63.63 -18.95 64.47 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.901 -0.59 . . . . 74.34 111.476 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.87 9.14 59.94 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.691 -0.766 . . . . 52.42 112.253 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -133.09 113.11 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.743 0.306 . . . . 50.35 110.395 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 11.0 mm-40 -58.4 -42.6 87.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 62.32 111.248 -178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -60.5 -41.5 94.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.888 0.375 . . . . 74.31 110.678 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 53' ' ' LEU . 77.1 mt -77.23 -32.09 55.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 64.34 111.019 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.554 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 72.5 m -67.86 -25.63 65.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.316 0.579 . . . . 74.33 110.362 176.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.1 mmt-85 -78.44 -35.12 47.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 55.13 110.143 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.502 HD12 HD23 ' A' ' 50' ' ' LEU . 81.8 mt -70.76 -55.4 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 70.41 111.132 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -108.42 -67.68 0.96 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.006 -0.543 . . . . 70.32 112.065 -170.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 51' ' ' THR . 42.3 t-20 50.86 -87.38 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.984 0.803 . . . . 71.15 111.977 -170.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -89.38 21.86 3.16 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.398 0.618 . . . . 71.33 110.662 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -130.55 59.73 1.65 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.345 -0.843 . . . . 63.34 108.839 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.762 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -92.0 -127.1 0.0 OUTLIER Pre-proline 0 N--CA 1.431 -1.388 0 CA-C-O 117.823 -1.084 . . . . 74.33 109.735 -178.578 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.762 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 80.4 Cg_exo -12.96 71.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 122.504 2.136 . . . . 73.42 114.069 -143.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.921 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -102.11 118.97 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.323 -0.853 . . . . 73.15 111.456 -170.326 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 12' ' ' VAL . 50.8 mt -83.05 103.24 12.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.066 -0.515 . . . . 72.02 110.501 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -91.52 119.39 31.42 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.371 -0.831 . . . . 62.23 109.709 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.03 103.68 5.31 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.506 -0.77 . . . . 30.12 110.523 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.521 HG21 ' HD2' ' A' ' 9' ' ' LYS . 61.0 t -74.61 150.12 7.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 108.977 -0.749 . . . . 71.04 108.977 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.0 t30 67.04 21.94 10.09 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.839 0.828 . . . . 45.04 109.696 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.473 ' HG3' ' HE1' ' A' ' 83' ' ' TYR . 1.0 OUTLIER -152.56 -44.41 0.1 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.31 -0.859 . . . . 75.11 109.091 -178.587 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.7 t70 70.89 81.41 0.16 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.944 -1.025 . . . . 71.13 111.355 176.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -176.34 164.25 2.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.472 -0.786 . . . . 73.33 109.82 175.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -91.66 129.82 37.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.315 -0.402 . . . . 73.01 109.98 172.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.0 mt -84.29 -49.58 8.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.168 -0.678 . . . . 74.34 109.168 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 14.5 t -170.99 167.91 7.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.395 -0.965 . . . . 61.51 108.395 177.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 1.7 p-80 -143.96 147.2 33.6 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.152 -0.219 . . . . 65.32 111.204 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 71.0 m-85 74.97 -44.95 0.56 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 124.174 0.921 . . . . 74.23 111.967 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -125.21 163.74 21.81 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.339 -0.615 . . . . 71.23 109.339 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.7 tp -113.64 101.2 9.1 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.368 -0.378 . . . . 70.21 111.566 -168.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -80.98 93.01 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.738 -0.467 . . . . 64.54 109.738 172.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.506 ' HA ' HG22 ' A' ' 80' ' ' ILE . 14.1 m -56.25 -34.42 66.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.84 -0.618 . . . . 75.33 110.574 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -58.82 -40.59 84.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.545 -0.752 . . . . 73.41 111.134 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 91.2 t -76.8 -49.26 24.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.131 -0.486 . . . . 73.41 111.716 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.506 HG22 ' HA ' ' A' ' 77' ' ' SER . 7.2 tp -63.36 -35.24 71.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 120.737 -0.385 . . . . 65.43 110.694 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.25 -36.19 91.4 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.89 -0.671 . . . . 60.45 111.708 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.16 75.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 64.11 110.751 177.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.473 ' HE1' ' HG3' ' A' ' 66' ' ' GLU . 40.3 t80 -87.18 -50.09 6.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.837 -0.619 . . . . 65.12 111.839 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -63.58 -45.56 89.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.289 -0.414 . . . . 61.3 111.503 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 C--N 1.32 -0.715 0 CA-C-N 116.325 -0.398 . . . . 74.51 110.762 -177.371 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 44.3 mt-10 . . . . . 0 N--CA 1.444 -0.762 0 N-CA-C 109.477 -0.564 . . . . 73.33 109.477 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 88.3 Cg_endo -89.37 -170.75 0.47 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.285 2.657 . . . . 54.42 112.889 -172.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 22.7 mmt180 -103.99 164.87 11.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.634 -0.712 . . . . 62.25 109.576 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.617 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 2.1 tmtp? -141.23 129.52 22.32 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.7 -0.481 . . . . 72.44 109.7 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 ' CD1' ' A' ' 80' ' ' ILE . 57.9 mt -113.84 139.85 48.82 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.079 -0.51 . . . . 63.23 111.598 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.547 HG23 ' CG2' ' A' ' 64' ' ' VAL . 53.3 t -112.26 129.57 67.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.63 -0.714 . . . . 73.22 109.336 170.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.614 HG22 HD23 ' A' ' 61' ' ' LEU . 39.2 t -99.11 114.25 36.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.752 -0.462 . . . . 52.31 109.752 174.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -89.62 126.01 35.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.928 -0.578 . . . . 52.23 110.464 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.05 -163.34 12.93 Favored Glycine 0 N--CA 1.443 -0.862 0 C-N-CA 120.737 -0.744 . . . . 63.44 111.714 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.527 ' HD2' ' OD1' ' A' ' 45' ' ' ASP . 1.2 ptm180 -149.34 160.54 43.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.195 -0.298 . . . . 75.34 110.195 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -62.45 110.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.237 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.4 -19.6 4.53 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.531 -0.842 . . . . 51.21 112.463 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.7 m -74.39 85.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.894 0.378 . . . . 73.53 110.539 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 44.0 m80 -70.86 -30.82 67.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 73.2 110.354 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.59 HD12 ' HB2' ' A' ' 73' ' ' TYR . 2.3 tm? -60.31 -32.12 70.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.775 -0.648 . . . . 72.51 109.779 176.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.754 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 53.9 t -67.76 -38.7 83.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 63.14 110.265 176.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' HD12 ' A' ' 25' ' ' ILE . 50.6 mt-10 -68.0 -32.59 73.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.639 -0.71 . . . . 64.42 110.51 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 18.2 mm-40 -62.89 -39.33 94.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.933 -0.576 . . . . 73.43 110.079 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 78.6 mtp -69.33 -27.29 65.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.562 -0.744 . . . . 72.11 110.936 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 22' ' ' GLU . 74.0 mt -57.01 -43.41 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.462 -0.335 . . . . 72.34 110.17 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.46 97.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 72.23 110.665 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.9 m -60.18 -47.98 83.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.73 -0.668 . . . . 54.41 110.668 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 88.5 mt -62.37 -43.13 99.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.795 -0.639 . . . . 73.43 111.009 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HD2' ' OE1' ' A' ' 32' ' ' GLN . 14.8 mmm180 -55.48 -43.48 75.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 72.22 111.575 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.0 t -65.46 -40.96 89.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.495 -0.321 . . . . 74.54 110.685 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 31' ' ' LEU . 2.2 mt -66.76 -35.14 79.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.637 -0.256 . . . . 71.11 111.014 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.679 HE22 ' HB2' ' A' ' 39' ' ' LEU . 98.9 mt-30 -60.58 -21.38 62.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 63.01 111.503 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -78.05 -13.43 59.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.3 110.799 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -42.23 5.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.96 -0.563 . . . . 70.32 109.985 175.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 31.8 m -141.02 121.03 13.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.448 -0.796 . . . . 64.51 109.869 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -85.45 125.15 32.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.057 0.456 . . . . 74.12 111.199 -175.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.516 ' HB3' HD11 ' A' ' 84' ' ' LEU . 10.5 p90 -133.46 17.07 4.01 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.723 -0.671 . . . . 74.33 111.291 178.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.9 mt-10 58.67 -178.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.418 0.627 . . . . 74.12 111.313 -176.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.679 ' HB2' HE22 ' A' ' 32' ' ' GLN . 4.8 tp -151.25 109.93 3.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.033 -0.531 . . . . 64.15 110.456 173.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.617 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 3.2 tp10 -108.76 143.82 37.39 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.512 -0.551 . . . . 62.11 109.512 178.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.89 108.07 17.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.587 -0.523 . . . . 65.15 109.587 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.496 HD12 HG11 ' A' ' 11' ' ' VAL . 59.5 mt -118.78 118.45 57.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.082 0.468 . . . . 74.44 111.079 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -78.07 115.74 18.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.735 -0.666 . . . . 73.12 109.818 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.588 HG22 ' HB3' ' A' ' 50' ' ' LEU . 26.7 pt -71.74 -34.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.111 -0.495 . . . . 71.12 111.458 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -64.88 98.1 0.26 Allowed 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.37 0.605 . . . . 65.42 110.768 178.062 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 146.72 -37.79 1.17 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.053 -1.219 . . . . 74.01 110.053 -176.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 50' ' ' LEU . 45.6 t-20 -97.65 109.02 21.86 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.527 -0.916 . . . . 74.41 108.527 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -50.62 -34.96 28.17 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 123.878 0.736 . . . . 74.24 111.383 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.71 -49.97 19.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.396 -0.366 . . . . 64.44 110.756 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.588 ' HB3' HG22 ' A' ' 44' ' ' ILE . 32.9 mt -66.42 -34.45 77.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.795 -0.184 . . . . 74.43 111.36 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.1 m -57.78 -56.41 22.27 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.892 -0.323 . . . . 61.23 110.163 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 52' ' ' ARG . 35.0 mmt180 -63.78 -31.55 72.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.594 0.235 . . . . 73.52 111.54 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.0 mt -69.89 -47.15 63.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.4 0.518 . . . . 74.34 112.4 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.494 ' HB2' HG21 ' A' ' 44' ' ' ILE . 96.9 m-85 -117.4 -9.56 10.87 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.33 1.233 . . . . 73.55 114.33 -167.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -76.84 82.97 3.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 119.078 0.854 . . . . 74.32 109.658 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.56 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 16.2 t70 -154.34 -59.42 0.12 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.633 -1.167 . . . . 74.51 109.075 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.56 ' HG3' ' O ' ' A' ' 56' ' ' ASP . 46.7 mtm180 -157.91 90.33 1.06 Allowed 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.28 -1.748 . . . . 72.4 106.28 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.487 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.12 -107.06 0.0 OUTLIER Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 113.473 0.916 . . . . 71.54 113.473 -161.811 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.754 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 96.4 Cg_exo -9.62 72.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.695 0 C-N-CA 122.709 2.272 . . . . 75.33 113.873 -140.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -98.28 135.23 33.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.322 -0.854 . . . . 52.2 110.968 -168.836 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.614 HD23 HG22 ' A' ' 12' ' ' VAL . 34.9 mt -93.52 107.83 19.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 64.41 110.796 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -92.45 123.6 35.87 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.636 -0.711 . . . . 73.23 110.519 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.8 107.14 7.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.803 -0.635 . . . . 74.44 109.553 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.547 ' CG2' HG23 ' A' ' 11' ' ' VAL . 92.3 t -69.78 -31.33 48.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.924 0.392 . . . . 65.32 111.661 -174.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.401 ' HB2' HH11 ' A' ' 8' ' ' ARG . 12.1 m120 -81.85 -44.73 16.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.139 0.495 . . . . 75.44 110.67 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.715 ' HB2' ' HE1' ' A' ' 83' ' ' TYR . 3.5 tp10 -85.55 -20.94 28.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.11 111.138 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 62.23 74.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.664 -0.698 . . . . 75.23 110.56 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.43 ' HE3' ' CG ' ' A' ' 66' ' ' GLU . 19.6 ptpt -172.55 158.08 4.09 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.656 -0.702 . . . . 74.42 110.061 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -84.4 118.79 24.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.0 -0.371 . . . . 71.14 110.0 173.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 82.8 mt -88.01 -68.53 0.75 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.602 0.715 . . . . 65.51 110.788 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.566 ' HB2' HD12 ' A' ' 61' ' ' LEU . 85.6 m -119.21 170.74 8.82 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.697 -1.138 . . . . 64.13 110.41 -173.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -132.65 -172.23 2.86 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.704 -0.68 . . . . 74.01 109.645 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.688 ' HA ' ' SD ' ' A' ' 24' ' ' MET . 21.6 p90 -52.45 138.31 27.7 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.71 -0.478 . . . . 73.35 109.71 175.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 82.4 m-85 70.67 98.59 0.06 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.957 0.786 . . . . 75.23 108.978 -167.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 tp -52.39 119.93 4.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.684 -1.144 . . . . 61.42 112.454 -170.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.525 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 4.7 m-20 -66.21 -31.46 72.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.919 -0.582 . . . . 74.34 109.712 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.2 m 72.91 -54.63 0.69 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.118 -0.946 . . . . 73.4 112.834 172.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -74.63 -48.75 24.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.524 0.202 . . . . 72.44 111.504 -175.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 15.4 t -56.32 -49.35 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 112.412 0.523 . . . . 65.2 112.412 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.68 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -64.6 -30.93 51.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 C-N-CA 120.302 -0.559 . . . . 72.34 110.507 177.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.82 -37.04 93.66 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.83 -0.7 . . . . 73.55 112.021 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.68 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.39 0.614 . . . . 33.44 111.019 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.715 ' HE1' ' HB2' ' A' ' 66' ' ' GLU . 81.3 t80 -84.35 -36.18 22.69 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 61.31 110.798 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.68 HD23 HD11 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -87.84 13.54 10.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.807 -0.633 . . . . 74.5 111.759 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.443 -0.344 . . . . 74.12 110.129 175.861 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.535 -0.172 . . . . 72.33 110.535 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -80.96 166.54 18.87 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.467 2.112 . . . . 74.55 112.544 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 3.8 mpt_? -95.22 171.68 8.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.968 -0.56 . . . . 72.02 109.882 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 45.8 mtpt -126.56 146.99 49.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.834 0.35 . . . . 65.54 110.829 175.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 80' ' ' ILE . 84.1 mt -120.42 128.24 53.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.814 -0.63 . . . . 75.22 110.1 174.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.534 HG22 ' HB3' ' A' ' 40' ' ' GLU . 55.4 t -108.5 127.41 64.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.896 -0.593 . . . . 55.12 110.305 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.689 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -98.94 108.2 21.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.772 -0.649 . . . . 74.43 109.276 174.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 1.018 ' HB2' HG23 ' A' ' 60' ' ' VAL . 19.0 m-85 -77.93 107.76 10.69 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.576 -0.45 . . . . 54.51 109.886 176.121 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -130.72 -145.51 5.71 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.946 -0.861 . . . . 32.42 110.946 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' HD11 ' A' ' 44' ' ' ILE . 6.7 ptm180 -174.78 110.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.878 0.339 . . . . 75.41 111.241 177.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 65.06 -87.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.663 -0.699 . . . . 75.32 111.727 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.46 134.52 5.21 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 121.03 -0.605 . . . . 74.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.574 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 44.1 t -153.29 141.29 20.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.918 -0.401 . . . . 74.43 109.918 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -60.22 -34.64 73.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 72.04 110.922 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.569 ' HG ' ' HD1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -73.72 -32.95 64.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.535 . . . . 71.11 111.243 -177.943 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.574 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 70.7 m -64.28 -42.19 96.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.472 -0.331 . . . . 70.1 110.455 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -54.4 -38.25 65.98 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.222 0.534 . . . . 71.14 110.437 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -74.75 -48.38 25.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.665 -0.698 . . . . 71.23 111.345 -176.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 87.3 mtp -67.13 -42.95 83.57 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.112 -0.235 . . . . 73.01 111.282 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.52 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 71.8 mt -58.74 -48.28 86.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.401 0.143 . . . . 64.13 110.926 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.952 0.406 . . . . 63.22 110.892 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 m -62.91 -43.89 97.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.795 -0.639 . . . . 64.53 111.074 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 92.9 mt -69.03 -35.25 76.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.31 -0.404 . . . . 64.12 111.373 -178.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm180 -57.77 -40.95 80.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.858 0.361 . . . . 62.0 110.864 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.46 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 78.5 t -67.31 -40.12 84.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 62.41 110.867 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.33 -32.06 72.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.69 -0.232 . . . . 72.42 111.23 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 95.3 mt-30 -57.65 -23.01 48.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 72.33 111.339 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -76.58 -19.18 58.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.143 -0.481 . . . . 71.31 111.177 -177.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -105.46 -40.25 5.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.124 0.488 . . . . 70.45 110.545 176.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.575 ' HB3' HD12 ' A' ' 84' ' ' LEU . 19.6 m -140.92 120.38 13.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.915 -0.584 . . . . 61.31 109.756 -178.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.7 t-105 -83.81 123.98 30.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.116 0.484 . . . . 71.14 111.159 -176.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 5.6 p90 -134.88 19.07 3.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.487 -0.779 . . . . 73.23 110.519 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 18.7 mm-40 59.01 -178.23 0.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.923 -0.58 . . . . 75.12 110.302 -176.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.483 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.6 tp -151.95 108.71 3.49 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.619 -0.512 . . . . 71.43 109.619 170.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.534 ' HB3' HG22 ' A' ' 11' ' ' VAL . 19.4 tt0 -120.28 117.9 29.03 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.569 -0.741 . . . . 71.15 109.473 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.06 108.6 25.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 73.54 109.534 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 70.3 mt -110.12 118.01 56.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.92 -0.582 . . . . 60.15 110.001 -177.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 87.4 m-20 -70.19 138.08 51.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.953 -0.567 . . . . 70.13 110.51 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.8 pt -65.89 -25.74 36.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.524 -0.917 . . . . 63.15 108.524 169.398 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 43' ' ' ASN . 10.6 t70 -57.11 112.01 1.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.589 -1.187 . . . . 63.01 109.548 170.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 120.42 -25.91 7.17 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.049 -0.82 . . . . 62.02 111.049 -174.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.411 HD22 HD12 ' A' ' 50' ' ' LEU . 92.0 m-20 -118.57 106.86 13.07 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.595 -0.52 . . . . 71.21 109.595 175.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.48 -33.79 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.216 -0.447 . . . . 74.32 111.176 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -69.17 -35.57 76.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.453 -0.339 . . . . 74.24 110.516 -176.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.497 ' HB3' HG22 ' A' ' 44' ' ' ILE . 71.5 mt -73.36 -44.28 59.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 71.04 110.887 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.573 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 38.4 m -65.97 -25.24 67.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.037 0.446 . . . . 63.42 110.921 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -38.54 89.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.321 0.581 . . . . 61.12 110.099 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 75.8 mt -90.43 -52.89 4.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.383 -0.826 . . . . 73.1 111.463 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 57' ' ' ARG . 18.9 m-85 -102.74 21.0 16.23 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.758 0.651 . . . . 64.34 112.758 -167.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.573 ' HB2' ' O ' ' A' ' 51' ' ' THR . 9.9 t30 -50.81 -44.24 59.03 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.774 0.321 . . . . 75.21 111.191 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -124.27 24.96 7.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.218 1.009 . . . . 71.31 109.271 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.697 ' HB2' ' HA ' ' A' ' 54' ' ' TYR . 5.0 mmp_? -136.32 36.97 2.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.419 -0.956 . . . . 72.33 108.419 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.6 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -83.16 -108.09 0.0 OUTLIER Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.37 -0.824 . . . . 50.13 110.56 -173.226 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.6 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 31.0 Cg_exo -15.01 68.01 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.481 0 C-N-CA 122.622 2.214 . . . . 74.54 114.124 -144.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 1.018 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -98.99 115.78 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 114.933 -1.03 . . . . 44.43 110.497 -172.323 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.689 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -86.64 105.13 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.584 -0.734 . . . . 72.23 109.528 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -92.28 129.46 38.22 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.959 -1.019 . . . . 75.35 110.58 -176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -84.79 105.74 15.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.521 -0.763 . . . . 73.13 110.683 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.467 HG21 HG23 ' A' ' 11' ' ' VAL . 24.9 t -79.35 84.09 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 65.14 110.586 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.41 ' HB2' ' OH ' ' A' ' 83' ' ' TYR . 0.0 OUTLIER 176.23 -54.46 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.992 -1.004 . . . . 45.43 109.248 178.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -98.0 -12.82 21.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.067 -0.969 . . . . 72.13 111.007 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 61.8 78.1 0.3 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.89 -0.595 . . . . 70.25 109.799 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.58 163.92 6.72 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.515 -0.766 . . . . 64.24 110.213 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -84.58 142.95 29.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.341 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.6 mt -99.88 -32.71 10.86 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.506 -0.553 . . . . 71.21 109.506 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.8 t -173.7 151.74 1.92 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.176 -0.92 . . . . 72.32 109.244 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.66 ' HB3' HG12 ' A' ' 60' ' ' VAL . 2.6 p-80 -135.24 129.96 34.47 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.716 -0.476 . . . . 75.32 109.716 173.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.569 ' HD1' ' HG ' ' A' ' 20' ' ' LEU . 96.8 m-85 66.71 122.15 0.02 OUTLIER 'General case' 0 C--O 1.235 0.341 0 O-C-N 124.239 0.962 . . . . 75.25 110.728 -170.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.47 ' H ' ' CD1' ' A' ' 20' ' ' LEU . 84.5 m-85 65.67 -160.85 0.27 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.077 -1.419 . . . . 74.13 109.603 -176.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.5 tp -136.98 117.34 13.64 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 120.088 -0.645 . . . . 71.45 111.761 -172.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -86.86 87.65 7.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.135 -0.484 . . . . 65.11 109.741 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 m -59.33 -32.3 69.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.809 -0.632 . . . . 74.23 110.753 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -59.16 -43.39 92.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.837 -0.62 . . . . 72.43 111.169 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.4 t -75.33 -46.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 72.53 111.562 -176.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.847 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.99 -30.91 48.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.257 -0.577 . . . . 72.15 110.323 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.23 -29.52 75.51 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.561 -0.828 . . . . 63.33 111.524 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.98 -26.54 36.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.089 0.471 . . . . 73.41 110.508 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.41 ' OH ' ' HB2' ' A' ' 65' ' ' ASN . 63.9 t80 -87.46 -52.55 5.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 73.21 112.157 -177.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.847 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.231 -0.44 . . . . 63.43 111.461 -170.169 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 75.32 110.188 177.04 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 109.682 -0.488 . . . . 75.41 109.682 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.8 122.81 5.55 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.401 2.067 . . . . 74.32 111.569 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -110.35 105.08 13.96 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 71.15 110.318 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 1.9 tmtp? -71.47 146.33 48.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.063 -0.971 . . . . 74.04 110.247 -173.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.653 HD12 ' CD1' ' A' ' 37' ' ' PHE . 98.5 mt -124.48 136.85 54.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.073 0.464 . . . . 62.25 111.347 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.717 HG23 HG21 ' A' ' 64' ' ' VAL . 39.3 t -114.48 135.72 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.89 -0.595 . . . . 72.03 110.17 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.667 HG22 HD23 ' A' ' 61' ' ' LEU . 98.5 t -107.54 106.84 21.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.565 -0.531 . . . . 74.42 109.565 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.862 ' HB2' HG23 ' A' ' 60' ' ' VAL . 89.7 m-85 -76.99 122.98 25.67 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.764 -0.828 . . . . 74.22 108.764 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -157.51 -169.26 21.06 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 119.503 -1.332 . . . . 62.41 112.922 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.828 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.3 ptm180 -154.6 144.58 21.77 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.848 -0.797 . . . . 73.22 108.848 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -75.83 87.92 2.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.046 0.451 . . . . 75.33 110.037 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.08 32.1 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.551 -0.749 . . . . 51.12 111.511 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 p -170.58 138.99 1.53 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.69 -0.485 . . . . 74.31 109.69 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -70.68 -29.89 66.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 54.55 112.127 -172.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.422 HD12 ' CD1' ' A' ' 73' ' ' TYR . 26.4 mt -55.78 -30.4 61.23 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.489 0.551 . . . . 72.12 112.489 -175.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' HG13 ' A' ' 25' ' ' ILE . 76.1 m -54.5 -50.5 67.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.327 . . . . 63.21 110.863 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.75 -35.59 81.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.115 -0.493 . . . . 61.12 110.834 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -68.76 -44.1 74.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.669 -0.696 . . . . 71.53 111.309 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.6 mtp -65.65 -37.53 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.925 -0.31 . . . . 75.31 111.157 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.0 mt -57.71 -52.38 58.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 110.143 -0.317 . . . . 63.11 110.143 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.44 89.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 60.13 110.879 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.8 m -59.15 -42.87 91.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.92 -0.582 . . . . 71.33 111.106 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.2 mt -68.45 -42.53 78.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 71.23 111.046 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -60.84 -26.44 67.35 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.97 0.359 . . . . 74.11 111.97 -175.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.79 -44.83 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.654 0.264 . . . . 75.52 110.602 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.87 -26.01 53.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.343 0.592 . . . . 74.13 109.82 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -60.98 -20.54 62.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.4 -0.818 . . . . 72.12 110.366 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -71.95 -16.83 62.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.828 -0.624 . . . . 75.04 111.514 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.35 -39.02 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.49 -0.323 . . . . 70.25 111.153 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.412 ' HB3' HD12 ' A' ' 84' ' ' LEU . 18.2 m -126.97 135.98 51.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.505 -0.316 . . . . 64.0 111.056 -174.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -84.13 110.93 18.88 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.224 -0.443 . . . . 72.34 110.478 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.896 ' HB3' HD11 ' A' ' 84' ' ' LEU . 32.4 p90 -132.57 6.18 4.06 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.93 -0.577 . . . . 72.04 110.744 176.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.582 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.8 mt-10 59.77 -177.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.675 . . . . 64.32 111.546 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -149.19 120.02 7.59 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.994 -0.548 . . . . 63.05 110.017 175.858 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.694 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 23.3 tt0 -131.29 118.03 19.78 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.822 -0.436 . . . . 62.42 109.822 177.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -103.9 114.24 42.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 109.543 -0.54 . . . . 63.23 109.543 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 HG11 ' A' ' 11' ' ' VAL . 62.6 mt -112.62 116.89 53.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.256 0.55 . . . . 74.43 111.04 -176.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -71.75 107.45 4.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 62.5 110.582 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 29.7 pt -76.34 -10.73 13.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.286 0.565 . . . . 75.34 109.62 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -46.81 -39.2 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.421 -1.263 . . . . 74.24 112.651 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.5 20.99 48.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.526 -0.845 . . . . 75.25 112.9 -176.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.488 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 15.6 t-20 -137.26 110.36 7.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.882 0.341 . . . . 71.5 110.564 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -59.02 -33.78 71.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.334 -0.394 . . . . 63.35 111.807 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 66.2 m170 -66.21 -52.19 50.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 73.45 110.404 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.35 -38.97 88.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.87 -0.604 . . . . 73.43 110.958 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.632 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 94.9 m -62.05 -40.97 97.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.872 0.367 . . . . 74.44 111.243 177.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 70.1 mtp85 -75.53 -31.98 60.3 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 122.077 -0.39 . . . . 63.13 110.576 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -64.12 -51.43 64.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 53.34 110.978 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -109.61 -72.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.067 -0.515 . . . . 72.02 111.596 -173.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.632 ' HB2' ' O ' ' A' ' 51' ' ' THR . 39.8 t-20 51.02 -81.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.691 0.797 . . . . 64.21 111.725 -169.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -91.23 8.6 35.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.686 0.755 . . . . 71.22 110.104 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.11 46.89 1.1 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.203 -0.666 . . . . 72.41 109.203 169.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.828 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -81.86 -142.24 0.0 OUTLIER Pre-proline 0 N--CA 1.447 -0.6 0 CA-C-O 118.578 -0.725 . . . . 72.25 110.653 -178.781 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.815 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 82.7 Cg_exo -8.01 71.38 0.0 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.885 0 C-N-CA 122.663 2.242 . . . . 51.52 113.885 -139.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.862 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.77 113.48 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.453 -0.794 . . . . 53.35 110.136 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.667 HD23 HG22 ' A' ' 12' ' ' VAL . 2.5 tm? -83.37 106.75 15.38 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.765 -0.652 . . . . 64.35 109.355 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -100.57 134.4 43.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.82 -1.082 . . . . 75.44 110.797 -175.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.57 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -84.91 106.19 16.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.841 -0.618 . . . . 75.41 110.943 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.717 HG21 HG23 ' A' ' 11' ' ' VAL . 49.1 t -86.31 91.93 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.937 0.399 . . . . 72.11 111.067 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 40.7 t-20 168.97 -57.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.666 -1.152 . . . . 42.13 108.21 176.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -91.21 -18.87 23.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.549 -0.75 . . . . 73.24 110.499 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.1 t70 68.05 87.02 0.13 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.689 -0.687 . . . . 71.24 110.002 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -167.37 165.53 14.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.312 -0.858 . . . . 75.1 109.467 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -108.99 137.8 46.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.892 -0.41 . . . . 74.03 109.892 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 61' ' ' LEU . 18.9 mt -96.79 -70.47 0.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.017 0.437 . . . . 74.0 110.869 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 21.4 p -143.91 160.63 40.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 51.44 110.189 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.54 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 24.2 p80 -139.54 144.47 37.88 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.159 -0.216 . . . . 71.03 110.999 179.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 6.6 m-85 74.54 -43.79 0.54 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.831 0.852 . . . . 72.44 112.81 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -135.56 137.0 41.59 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.202 -0.666 . . . . 72.01 109.202 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 17.8 tp -89.71 110.71 21.58 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.049 0.452 . . . . 60.31 110.525 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -64.97 -28.41 69.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.805 -0.634 . . . . 61.02 111.087 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.0 m 75.77 -40.99 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.804 -0.635 . . . . 72.31 112.143 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -76.6 -45.97 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.071 -0.393 . . . . 62.21 110.455 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.3 t -55.31 -49.83 69.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.171 -0.468 . . . . 72.24 111.68 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.525 HD11 HD11 ' A' ' 10' ' ' LEU . 7.2 tp -66.83 -34.75 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 64.32 110.397 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.24 -22.84 77.57 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.879 -0.677 . . . . 63.52 111.972 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.16 -32.76 56.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.166 0.507 . . . . 72.22 110.173 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.441 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 85.2 t80 -87.09 -38.97 16.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.637 -0.71 . . . . 61.01 111.804 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.896 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -79.17 4.02 16.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.637 0.606 . . . . 74.41 112.637 -171.453 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.606 -0.516 . . . . 71.35 109.606 173.293 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 1.2 mm-40 . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 108.609 -0.886 . . . . 70.21 108.609 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB3' ' HD1' ' A' ' 36' ' ' TRP . 87.3 Cg_endo -76.66 158.93 35.57 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.02 1.814 . . . . 64.11 111.827 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.696 ' NH2' ' O ' ' A' ' 85' ' ' SER . 44.9 mtt180 -81.21 -21.64 39.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.418 -0.356 . . . . 70.04 111.436 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 3.9 tmtp? 64.34 108.52 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.933 0.771 . . . . 62.43 112.828 170.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 80' ' ' ILE . 32.0 mt -105.43 133.01 50.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.618 -0.719 . . . . 52.21 110.811 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.6 t -109.85 131.69 60.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.687 -0.688 . . . . 64.52 109.84 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.52 HG22 ' CD2' ' A' ' 61' ' ' LEU . 62.3 t -99.31 109.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.829 -0.434 . . . . 71.34 109.829 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.956 ' HB2' HG23 ' A' ' 60' ' ' VAL . 12.9 m-85 -84.33 120.33 26.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.138 -0.483 . . . . 71.52 110.124 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.485 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -138.87 170.5 23.99 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.157 -0.777 . . . . 63.02 111.157 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.413 ' HG2' HG21 ' A' ' 58' ' ' VAL . 12.2 ptm180 -135.72 123.66 22.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.12 0.46 . . . . 75.23 110.813 178.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 61.27 -81.53 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.262 0.976 . . . . 60.32 112.454 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.82 139.36 6.01 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.673 -0.775 . . . . 44.12 112.203 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.2 m -148.84 115.71 6.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.1 -0.333 . . . . 73.02 110.1 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -56.48 -46.84 80.25 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.983 0.421 . . . . 63.11 111.098 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.568 HD11 ' H ' ' A' ' 74' ' ' PHE . 1.9 tm? -63.98 -32.15 73.59 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.767 -0.651 . . . . 63.12 110.707 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.581 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 42.1 t -67.33 -38.68 85.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.535 -0.302 . . . . 62.23 110.557 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.21 -39.92 73.24 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.493 0.663 . . . . 75.4 110.22 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -69.89 -34.18 73.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.085 -0.961 . . . . 54.22 110.843 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.494 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 73.3 mtp -68.0 -42.18 81.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 43.43 109.982 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 79.7 mt -55.83 -46.12 79.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.748 -0.66 . . . . 55.12 110.728 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.01 98.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.509 . . . . 73.34 110.91 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 m -60.52 -39.09 86.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.291 0.567 . . . . 73.51 110.717 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.537 HD11 HD21 ' A' ' 61' ' ' LEU . 84.3 mt -71.24 -33.8 70.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.999 -0.546 . . . . 63.3 111.684 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.14 -40.73 96.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.362 . . . . 72.42 110.213 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 63.0 t -66.76 -43.65 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.22 110.858 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.457 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.0 mt -63.03 -33.66 75.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.69 -0.232 . . . . 70.33 111.27 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.534 ' OE1' ' HB2' ' A' ' 39' ' ' LEU . 17.6 mt-30 -58.94 -25.27 63.35 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.876 0.324 . . . . 63.23 111.876 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -75.37 -19.39 59.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.077 0.465 . . . . 74.54 110.734 -179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -101.33 -44.68 5.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 72.34 109.689 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 13.5 m -139.22 120.35 14.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 64.23 109.582 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.434 ' HD1' ' HB3' ' A' ' 7' ' ' PRO . 56.5 t-105 -83.61 124.01 30.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.391 0.615 . . . . 64.51 111.226 -174.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.53 ' CD1' HD12 ' A' ' 10' ' ' LEU . 4.4 p90 -135.45 13.95 3.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.864 -0.607 . . . . 75.41 111.369 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 17.0 mm-40 60.44 174.45 0.1 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.465 0.65 . . . . 72.21 111.584 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.534 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 9.1 tp -151.32 112.76 4.38 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.133 -0.485 . . . . 61.22 110.726 173.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.63 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 28.1 tt0 -124.77 118.76 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -99.94 120.52 49.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.865 -0.421 . . . . 73.23 109.865 -177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 71.2 mt -125.82 121.13 59.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.941 0.401 . . . . 73.12 111.178 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 9.3 m120 -66.62 125.7 26.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.742 -0.663 . . . . 72.54 111.162 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.44 HG22 HD13 ' A' ' 50' ' ' LEU . 22.3 pt -88.12 -23.24 6.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.459 -0.337 . . . . 74.0 110.268 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -59.92 117.18 4.73 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.383 0.611 . . . . 64.43 110.429 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.24 -31.02 6.95 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.482 -0.781 . . . . 31.34 111.465 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -92.79 113.34 25.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.233 -0.654 . . . . 73.02 109.233 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -38.13 89.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.696 -0.229 . . . . 64.1 111.553 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -60.6 -51.51 69.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.28 0.562 . . . . 74.04 110.4 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 44' ' ' ILE . 92.6 mt -67.58 -37.56 82.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.668 -0.697 . . . . 63.44 111.253 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.676 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 63.8 m -66.57 -43.46 84.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 75.54 110.842 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -67.28 -37.39 83.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.819 0.342 . . . . 75.4 110.293 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.2 -55.92 13.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.047 -0.524 . . . . 63.21 111.46 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.86 -66.07 0.97 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.394 -0.366 . . . . 71.5 111.529 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.676 ' HB2' ' O ' ' A' ' 51' ' ' THR . 58.7 t30 51.92 -83.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.111 0.782 . . . . 72.44 113.111 -175.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -85.44 -16.41 39.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.983 -0.553 . . . . 72.0 111.676 -170.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.62 78.0 1.48 Allowed 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.347 -1.353 . . . . 64.35 107.347 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.55 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.28 -97.54 0.0 OUTLIER Pre-proline 0 N--CA 1.423 -1.794 0 CA-C-O 118.163 -0.922 . . . . 70.23 110.676 -175.657 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.581 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 85.3 Cg_exo -21.29 75.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.821 2.347 . . . . 75.25 114.154 -149.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.956 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -107.23 122.89 62.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.267 -0.879 . . . . 71.51 110.798 -170.764 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 28' ' ' LEU . 48.1 mt -85.01 109.56 18.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.084 0.469 . . . . 72.42 110.769 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 88.1 t80 -92.46 124.11 36.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.448 -0.796 . . . . 74.31 110.691 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.83 109.17 16.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.744 . . . . 70.15 109.719 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.614 HG21 ' HD2' ' A' ' 9' ' ' LYS . 57.8 t -73.21 -20.53 18.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.289 -0.414 . . . . 43.41 111.794 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.49 -51.78 18.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.951 0.352 . . . . 64.42 111.951 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -100.95 -5.19 26.27 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.823 0.344 . . . . 72.21 111.464 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 63.61 78.87 0.27 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.495 0.664 . . . . 65.25 111.344 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.465 ' NZ ' ' HB2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -176.98 177.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.111 -0.95 . . . . 73.12 108.82 175.175 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.52 156.38 17.32 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 120.905 0.383 . . . . 72.32 110.694 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.414 ' HB3' HG12 ' A' ' 79' ' ' VAL . 66.1 mt -111.1 -76.32 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.621 0.724 . . . . 74.04 110.403 177.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 41.5 t -115.7 142.92 46.1 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.574 -1.194 . . . . 64.34 109.737 -175.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 17.7 p-80 -133.13 130.05 38.72 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.302 -0.408 . . . . 73.44 110.481 177.024 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.404 ' CZ ' ' HD2' ' A' ' 59' ' ' PRO . 71.4 m-85 68.7 140.02 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.099 -0.955 . . . . 74.42 112.348 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.568 ' H ' HD11 ' A' ' 20' ' ' LEU . 98.8 m-85 58.1 -105.77 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.205 -1.361 . . . . 63.34 111.352 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 12.0 tp 172.36 107.46 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 123.764 0.665 . . . . 74.04 109.537 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -71.73 -25.68 62.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 74.3 109.966 176.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.0 m 69.08 -55.03 0.56 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.116 -0.947 . . . . 65.14 112.189 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.12 -43.7 91.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.689 0.28 . . . . 71.11 111.733 -177.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 70' ' ' LEU . 84.1 t -64.12 -46.28 94.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.476 -0.329 . . . . 64.43 111.74 -177.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 10' ' ' LEU . 6.0 tp -70.51 -33.86 55.2 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 119.989 -0.685 . . . . 41.4 109.79 176.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.63 99.69 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.797 -0.716 . . . . 54.3 111.587 176.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.95 -32.02 71.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 63.25 110.907 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.834 -0.621 . . . . 74.12 111.065 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.7 OUTLIER -92.04 13.56 18.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 70.01 111.926 -176.228 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.696 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 67.7 m . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 110.028 -0.36 . . . . 65.14 110.028 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.485 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 13.4 pt-20 . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.439 -0.578 . . . . 72.44 109.439 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.485 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 61.2 Cg_endo -70.44 162.92 40.67 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.118 1.879 . . . . 63.3 111.461 177.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -101.52 173.27 6.51 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.366 -0.379 . . . . 75.23 110.482 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.536 ' HG2' ' HB2' ' A' ' 38' ' ' GLU . 19.8 mtpt -135.05 126.6 28.78 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.975 -0.557 . . . . 74.41 109.946 174.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.405 HD11 HD11 ' A' ' 80' ' ' ILE . 37.0 mt -108.45 120.79 43.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.868 -0.605 . . . . 75.25 110.305 173.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 40' ' ' GLU . 79.6 t -102.11 126.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.726 -0.67 . . . . 73.43 109.573 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.558 HG22 HD23 ' A' ' 61' ' ' LEU . 59.2 t -96.55 105.98 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 109.193 -0.669 . . . . 64.33 109.193 175.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.581 ' O ' HG23 ' A' ' 60' ' ' VAL . 35.6 m-85 -82.95 105.15 13.71 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.26 -0.644 . . . . 74.21 109.26 174.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.57 -168.15 12.65 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.568 -0.825 . . . . 60.33 111.488 -177.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.876 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.1 ptm180 -169.76 -159.03 0.2 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.882 -0.784 . . . . 74.42 108.882 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.98 109.04 0.28 Allowed 'General case' 0 C--N 1.318 -0.793 0 O-C-N 124.185 0.928 . . . . 73.21 109.271 171.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -155.31 -170.69 21.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.299 -0.953 . . . . 45.0 112.8 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.02 -155.09 0.59 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.562 0.22 . . . . 73.42 110.424 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 13.2 p80 -52.92 -33.23 49.69 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.988 1.107 . . . . 71.54 113.988 -170.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 20' ' ' LEU . 16.8 mt -56.62 -34.75 67.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.602 0.637 . . . . 62.41 112.025 -176.038 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 37.0 t -63.62 -43.9 95.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.425 -178.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -85.24 -21.29 29.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.52 -0.309 . . . . 73.51 111.29 -177.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.7 mt-10 -66.19 -44.74 83.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.864 0.364 . . . . 72.14 110.121 175.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.555 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.9 mtp -62.77 -40.58 97.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.001 -0.545 . . . . 75.43 110.28 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.564 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.6 mt -58.35 -49.85 80.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 54.4 110.562 176.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.48 94.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.362 -0.381 . . . . 63.23 111.194 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -61.3 -43.38 98.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.032 -0.531 . . . . 73.52 110.579 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.624 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 83.1 mt -66.04 -30.8 71.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 75.01 111.2 -179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 14.3 mmm180 -63.16 -38.67 92.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.95 0.405 . . . . 72.44 110.411 177.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.9 t -73.4 -40.54 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 73.34 110.617 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 31' ' ' LEU . 6.8 mt -64.81 -31.79 73.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 74.1 111.142 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -58.23 -24.85 60.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.719 0.295 . . . . 52.32 111.701 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -70.22 -28.97 65.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 74.54 110.537 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -93.71 -44.8 7.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 70.51 110.462 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.4 m -143.17 117.86 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.673 -0.694 . . . . 71.04 110.142 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.9 t-105 -78.13 128.92 34.53 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.11 0.481 . . . . 62.11 110.834 -178.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.624 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 2.6 p90 -141.72 20.18 2.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 70.21 110.82 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.536 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 63.5 mm-40 59.28 -178.2 0.09 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.147 0.499 . . . . 72.51 110.849 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.555 HD21 HG23 ' A' ' 25' ' ' ILE . 4.5 tp -151.6 109.9 3.76 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.686 -0.405 . . . . 71.24 110.718 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.515 ' HB3' HG22 ' A' ' 11' ' ' VAL . 24.1 tt0 -124.15 117.65 25.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.842 -0.617 . . . . 75.11 109.426 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.57 124.07 68.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.134 -0.484 . . . . 75.15 109.866 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.0 mt -128.9 117.75 45.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.419 -0.355 . . . . 71.53 111.176 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -67.69 114.47 6.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.998 -0.546 . . . . 51.33 111.047 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.6 pt -83.38 -8.85 11.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.452 -0.34 . . . . 65.03 110.62 177.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 15' ' ' ARG . 5.6 p-10 -74.97 -17.13 60.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 74.14 110.581 178.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.31 -8.58 59.87 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.942 -0.646 . . . . 53.54 111.954 177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -125.71 101.08 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.966 -0.383 . . . . 65.34 109.966 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 1.6 mp0 -54.43 -33.87 60.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.898 -0.592 . . . . 64.13 112.017 -174.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -66.57 -37.53 85.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 72.52 110.263 -177.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 53' ' ' LEU . 74.8 mt -74.9 -24.41 58.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.373 -0.376 . . . . 54.33 110.284 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 4.8 m -64.99 -33.68 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.407 0.622 . . . . 63.15 109.62 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 mmt85 -77.37 -32.51 55.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.864 -0.607 . . . . 72.51 110.207 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 50' ' ' LEU . 82.7 mt -79.15 -24.38 43.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.531 -0.759 . . . . 70.34 111.627 -178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -136.44 -75.51 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.645 0.239 . . . . 72.41 111.645 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.641 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.3 t30 46.33 -86.71 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.887 0.875 . . . . 73.52 112.882 -171.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -91.29 49.68 1.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.639 0.733 . . . . 73.25 110.29 -173.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG22 ' A' ' 60' ' ' VAL . 5.7 ttm-85 -156.44 32.05 0.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.703 -1.221 . . . . 44.24 107.703 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.876 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -73.78 -141.93 0.0 OUTLIER Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.272 0.841 . . . . 43.35 113.272 -166.944 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.76 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 41.0 Cg_exo -2.53 73.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 122.305 2.003 . . . . 72.14 112.956 -136.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -93.42 116.13 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 114.766 -1.107 . . . . 60.23 111.044 -169.213 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.558 HD23 HG22 ' A' ' 12' ' ' VAL . 32.9 mt -82.65 103.02 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.092 0.472 . . . . 72.54 110.35 173.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 82.1 t80 -95.19 126.05 40.25 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.171 -0.922 . . . . 70.01 110.013 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.98 108.26 15.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.146 -0.479 . . . . 45.15 110.739 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.451 ' CG2' HG23 ' A' ' 11' ' ' VAL . 51.0 t -77.93 147.19 7.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.11 -0.495 . . . . 63.01 109.731 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 67.45 26.35 8.32 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.076 -0.713 . . . . 74.14 109.076 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.575 ' HG2' ' HE2' ' A' ' 68' ' ' LYS . 7.7 tp10 -149.27 -45.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.051 -0.977 . . . . 71.23 109.433 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.503 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 t70 73.28 37.63 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.972 -1.013 . . . . 75.54 111.591 172.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HE2' ' HG2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -149.47 167.04 27.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.137 -0.483 . . . . 74.43 110.045 176.277 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -94.24 157.97 15.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.025 0.44 . . . . 64.14 111.633 -172.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.443 ' CD1' HD13 ' A' ' 80' ' ' ILE . 54.2 mt -112.7 -62.81 1.53 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 62.45 110.033 173.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.3 t -153.8 153.6 32.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 70.13 110.098 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.534 ' CD2' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -128.43 149.35 50.6 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.962 -0.385 . . . . 74.42 109.962 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.411 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 68.0 m-85 74.85 -33.64 0.25 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.81 0.844 . . . . 71.1 113.037 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -141.48 -177.91 5.38 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.016 -0.735 . . . . 75.41 109.016 -174.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 tp -121.1 111.93 18.05 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.779 -0.368 . . . . 74.33 111.195 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -90.69 98.3 11.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.185 -0.672 . . . . 64.41 109.185 175.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.0 m -61.55 -32.09 72.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.09 -0.505 . . . . 72.02 111.635 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.4 -48.33 67.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.86 0.362 . . . . 55.52 110.774 -176.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -66.86 -48.82 78.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.235 -0.439 . . . . 70.14 111.993 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.533 HD11 HD23 ' A' ' 84' ' ' LEU . 8.6 tp -69.69 -30.72 45.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.432 -0.507 . . . . 71.22 110.189 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -30.48 77.69 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.805 -0.712 . . . . 70.11 111.61 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.7 -37.82 55.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.927 0.394 . . . . 74.32 110.697 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -78.69 -54.86 5.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.021 -0.536 . . . . 72.41 111.515 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.559 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -76.3 -38.4 56.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.126 -0.488 . . . . 43.35 110.851 -175.741 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 115.557 -0.747 . . . . 72.3 111.243 -176.694 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.48 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 41.4 mt-10 . . . . . 0 N--CA 1.446 -0.67 0 N-CA-C 109.504 -0.554 . . . . 73.41 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.48 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 68.4 Cg_endo -68.79 132.12 24.2 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.52 2.147 . . . . 60.35 113.025 -172.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.976 ' NH1' ' O ' ' A' ' 85' ' ' SER . 8.7 ptp180 -88.31 130.34 35.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.589 -0.893 . . . . 75.23 108.589 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.62 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.5 tttt -96.09 155.98 16.53 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.134 0.42 . . . . 71.34 112.134 -166.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.614 HD11 HD11 ' A' ' 80' ' ' ILE . 89.7 mt -125.85 148.3 49.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.908 -0.587 . . . . 71.4 110.215 173.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.609 HG23 HG21 ' A' ' 64' ' ' VAL . 55.1 t -127.03 135.51 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 116.239 -0.437 . . . . 71.3 109.958 175.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.724 HG22 HD23 ' A' ' 61' ' ' LEU . 86.8 t -108.85 119.62 58.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.344 -0.389 . . . . 50.34 110.155 176.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -95.9 115.84 28.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.843 -0.429 . . . . 63.51 109.843 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -139.07 -170.48 11.86 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.379 -0.915 . . . . 65.02 112.104 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB2' ' OD2' ' A' ' 45' ' ' ASP . 16.4 ptm180 -154.48 -177.35 6.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.827 -0.434 . . . . 74.12 109.827 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -78.32 155.6 30.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.146 -0.479 . . . . 72.52 110.825 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.33 31.87 45.03 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.937 -0.649 . . . . 52.03 112.138 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.1 m -143.09 94.08 2.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.803 0.335 . . . . 71.33 110.918 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -70.93 -28.75 64.73 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.24 0.543 . . . . 72.42 110.031 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.46 -34.45 64.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.09 -0.959 . . . . 44.34 110.279 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.9 t -68.13 -37.19 80.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 52.32 110.197 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.407 ' HA ' HD12 ' A' ' 25' ' ' ILE . 40.6 mt-10 -68.92 -33.14 73.26 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.217 0.532 . . . . 73.43 110.094 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.08 -36.7 84.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.657 -0.701 . . . . 73.13 110.409 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 85.2 mtp -63.99 -43.97 94.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.026 -0.533 . . . . 43.43 109.928 174.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.0 mt -55.05 -49.57 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.944 -0.571 . . . . 60.51 110.99 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.15 93.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.933 0.397 . . . . 72.01 110.919 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -62.98 -41.36 99.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.798 -0.637 . . . . 64.14 110.688 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.549 HD23 HD13 ' A' ' 39' ' ' LEU . 8.3 mp -66.45 -33.25 75.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.774 -0.648 . . . . 62.14 111.396 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.36 -42.19 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.893 0.378 . . . . 71.41 110.372 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.533 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 62.8 t -66.38 -44.37 90.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 64.22 110.71 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.41 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 11.8 mt -63.72 -33.61 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.53 -0.305 . . . . 73.45 111.505 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.478 ' OE1' ' HB2' ' A' ' 39' ' ' LEU . 10.8 mt-30 -58.4 -22.41 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.872 0.367 . . . . 72.25 111.898 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 49.6 mtmt -81.91 -11.45 58.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.165 0.507 . . . . 62.4 110.769 -178.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -110.56 -44.23 3.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.622 -0.717 . . . . 71.24 109.961 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.467 ' HB3' HD12 ' A' ' 84' ' ' LEU . 73.0 m -137.92 115.2 11.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.998 -1.001 . . . . 63.25 109.535 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -80.86 125.16 29.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.065 0.46 . . . . 71.02 110.806 -178.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.859 ' HB3' HD11 ' A' ' 84' ' ' LEU . 5.6 p90 -134.37 17.74 3.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.582 -0.736 . . . . 72.25 110.869 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.62 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 12.9 mm-40 59.98 -179.41 0.09 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.33 0.586 . . . . 75.52 110.304 -175.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.549 HD13 HD23 ' A' ' 28' ' ' LEU . 5.2 tp -152.54 112.55 4.0 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.538 -0.465 . . . . 75.52 111.291 172.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.516 ' HB3' HG22 ' A' ' 11' ' ' VAL . 22.7 tt0 -120.01 117.8 28.98 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.412 -0.588 . . . . 72.34 109.412 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.5 t -105.61 108.23 24.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.945 -0.571 . . . . 75.31 109.694 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.4 mt -108.5 113.02 42.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.852 -0.613 . . . . 71.52 110.526 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.453 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.7 m120 -81.1 124.77 29.49 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.644 . . . . 65.44 110.17 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.675 HG22 ' HB3' ' A' ' 50' ' ' LEU . 43.0 pt -69.97 -30.12 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.334 -0.394 . . . . 74.33 110.106 177.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -63.7 94.29 0.09 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.208 0.527 . . . . 63.25 109.874 170.519 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.02 -27.94 2.27 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.55 -1.02 . . . . 70.21 110.55 -174.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -120.65 109.29 15.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.938 -0.393 . . . . 65.51 109.938 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -58.5 -42.75 88.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.048 -0.524 . . . . 75.35 110.712 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -58.48 -41.26 84.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.411 . . . . 74.1 111.25 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.675 ' HB3' HG22 ' A' ' 44' ' ' ILE . 80.9 mt -76.31 -30.33 57.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.585 -0.279 . . . . 63.41 110.901 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.4 m -61.96 -45.35 94.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.085 0.469 . . . . 74.2 110.081 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -63.99 -30.91 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.063 -0.517 . . . . 71.23 110.926 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.07 -44.28 12.41 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.084 0.772 . . . . 75.11 113.084 -174.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.518 ' HB2' HG21 ' A' ' 44' ' ' ILE . 92.7 m-85 -117.03 -2.92 11.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.817 1.043 . . . . 73.53 113.817 -167.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -77.76 82.85 4.13 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 119.485 -0.886 . . . . 71.44 111.219 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.0 t70 171.63 -48.29 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 114.557 -1.201 . . . . 72.1 108.484 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 60' ' ' VAL . 18.0 ptt180 -109.1 54.11 0.67 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.419 -1.264 . . . . 71.13 109.613 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.811 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -144.97 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 112.228 0.455 . . . . 50.44 112.228 -171.402 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.811 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 67.8 Cg_exo -4.89 77.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.642 0 C-N-CA 122.599 2.199 . . . . 64.45 113.72 -138.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -92.12 128.05 43.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.087 -0.96 . . . . 74.22 110.469 -171.641 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.724 HD23 HG22 ' A' ' 12' ' ' VAL . 2.1 tm? -102.03 108.11 19.44 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.381 -0.599 . . . . 75.21 109.381 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -99.86 141.91 32.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.347 -0.842 . . . . 73.52 111.258 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.598 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -92.38 111.5 23.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.594 . . . . 73.22 111.0 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.609 HG21 HG23 ' A' ' 11' ' ' VAL . 21.6 t -99.42 88.37 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.587 0.708 . . . . 44.32 110.819 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 t30 175.29 -44.34 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.045 -1.835 . . . . 73.31 106.045 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 54.1 tt0 -125.53 104.83 8.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.71 -1.586 . . . . 60.2 107.474 163.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -52.12 90.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 124.264 0.977 . . . . 54.24 111.741 -175.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 25.6 pttm -160.85 156.62 25.34 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.842 -1.072 . . . . 64.31 110.105 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -89.84 141.04 29.01 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.637 -0.505 . . . . 74.15 109.637 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.3 mt -94.21 -55.67 3.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.45 110.166 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.2 t -158.63 175.13 14.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.03 -0.532 . . . . 52.1 109.852 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 7.7 p80 -144.2 136.77 26.84 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.802 -0.444 . . . . 52.02 109.802 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 96.0 m-85 73.99 139.56 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.518 1.136 . . . . 63.13 111.268 -174.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 61.15 -141.84 0.5 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.063 -0.971 . . . . 73.51 110.132 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 75' ' ' LEU . 14.0 tp -153.83 113.93 3.91 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.463 -0.495 . . . . 72.4 110.419 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.417 ' OD2' ' HB ' ' A' ' 79' ' ' VAL . 4.4 p-10 -58.66 -38.99 79.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.653 -0.703 . . . . 74.2 109.965 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.68 -49.8 0.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.364 -0.834 . . . . 65.33 112.004 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -79.22 -40.06 31.65 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.618 0.229 . . . . 64.42 111.618 -176.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.417 ' HB ' ' OD2' ' A' ' 76' ' ' ASP . 54.1 t -69.53 -47.65 70.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.62 0.247 . . . . 74.25 110.535 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.614 HD11 HD11 ' A' ' 10' ' ' LEU . 10.2 tp -65.57 -31.07 52.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.845 -0.342 . . . . 54.13 110.095 174.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.66 -29.14 74.48 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 120.768 -0.73 . . . . 64.33 111.61 176.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.73 -39.58 26.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.265 0.555 . . . . 72.34 110.278 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.598 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 82.3 t80 -71.88 -32.07 67.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.576 -0.738 . . . . 75.42 111.493 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.859 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -92.22 8.12 39.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.118 -0.492 . . . . 71.53 111.323 -178.319 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.976 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 8.3 t . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.176 -0.675 . . . . 52.54 109.176 176.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.592 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.9 pt-20 . . . . . 0 N--CA 1.448 -0.56 0 N-CA-C 108.659 -0.867 . . . . 72.12 108.659 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.592 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.3 Cg_endo -73.46 130.06 14.53 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.855 1.703 . . . . 72.0 111.892 -176.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -96.27 -172.45 2.54 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.931 -0.766 . . . . 71.32 108.931 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 38' ' ' GLU . 26.3 mtpt -139.77 120.09 13.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.235 0.54 . . . . 65.51 111.138 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 80' ' ' ILE . 29.7 mt -107.34 123.64 48.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.349 -0.841 . . . . 72.22 110.59 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.627 HG22 ' HB3' ' A' ' 40' ' ' GLU . 47.8 t -102.28 127.17 56.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.874 -0.603 . . . . 73.13 109.51 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 ' CD2' ' A' ' 61' ' ' LEU . 40.7 t -104.02 108.8 25.47 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.091 -0.504 . . . . 54.42 109.913 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.902 ' HB2' HG12 ' A' ' 60' ' ' VAL . 45.5 m-85 -79.58 112.57 16.97 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.986 -0.746 . . . . 73.43 108.986 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.74 179.67 16.58 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.639 -0.791 . . . . 32.23 112.218 -177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.524 ' HG2' ' HB2' ' A' ' 45' ' ' ASP . 0.3 OUTLIER -151.56 118.57 5.86 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.34 -0.615 . . . . 74.03 109.34 -176.827 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.69 107.16 0.56 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.933 -0.576 . . . . 61.52 110.883 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.11 -20.01 4.06 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.584 -0.735 . . . . 64.14 111.366 -175.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 15' ' ' ARG . 60.5 m -87.56 118.94 27.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.869 0.366 . . . . 64.25 110.264 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.6 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 33.4 t60 -71.41 -33.56 69.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.51 . . . . 72.34 111.328 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -65.25 -31.01 71.94 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.778 -0.369 . . . . 74.21 110.842 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.406 ' O ' HG13 ' A' ' 25' ' ' ILE . 42.9 t -54.97 -47.31 74.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.989 -178.069 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 13.9 pt-20 -71.16 -32.22 68.65 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.364 -0.38 . . . . 73.25 110.945 -178.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.0 mt-10 -71.61 -34.9 70.24 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.074 -0.512 . . . . 72.32 110.522 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.79 ' HG3' ' HB3' ' A' ' 59' ' ' PRO . 87.1 mmm -63.83 -43.04 97.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.902 -0.59 . . . . 74.23 110.123 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.623 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 77.1 mt -54.4 -50.58 56.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 74.4 110.78 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.84 -39.74 86.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.343 -0.39 . . . . 65.34 110.973 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -61.64 -44.0 97.8 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.949 -0.569 . . . . 75.23 110.704 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -66.11 -38.46 88.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.96 -0.564 . . . . 51.54 111.299 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.1 mmm180 -58.2 -41.83 84.86 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.676 0.274 . . . . 72.51 111.574 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.558 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 60.0 t -68.89 -40.49 81.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.856 0.36 . . . . 71.11 111.056 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -33.55 70.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.02 0.438 . . . . 63.43 109.92 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.59 -30.15 69.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.53 -0.759 . . . . 72.03 110.742 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 52.7 mtmt -69.28 -33.62 73.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 75.23 110.749 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -83.15 -46.06 13.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.619 -0.718 . . . . 73.5 110.281 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.453 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.9 m -135.22 118.24 16.38 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.661 -0.7 . . . . 74.3 109.511 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -76.99 117.81 18.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.476 0.655 . . . . 63.02 111.447 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -129.34 22.98 5.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.303 -0.862 . . . . 74.22 110.43 177.427 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 19.9 mm-40 57.4 -179.93 0.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.501 -175.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.401 ' HA ' HD12 ' A' ' 39' ' ' LEU . 11.3 tp -152.55 117.03 4.99 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.877 -0.729 . . . . 73.44 110.778 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 11' ' ' VAL . 14.9 tt0 -124.41 117.39 24.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.872 -0.788 . . . . 60.14 108.872 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 56.3 t -109.04 111.43 36.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.305 -0.407 . . . . 73.03 109.905 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.6 mt -117.86 109.93 29.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.062 -0.517 . . . . 73.21 110.741 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.69 124.82 27.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.978 177.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.562 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.7 pt -86.8 -14.55 10.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.56 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.524 ' HB2' ' HG2' ' A' ' 15' ' ' ARG . 13.6 t70 -56.51 -34.67 67.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.841 -0.618 . . . . 75.41 111.82 -174.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.9 27.41 10.09 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.704 -0.76 . . . . 73.25 113.02 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 22.6 t-20 -152.76 115.66 4.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.645 -0.327 . . . . 73.44 110.512 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.69 -34.92 67.9 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.797 0.295 . . . . 73.05 111.797 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 36.5 m80 -69.34 -53.86 17.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.801 -0.444 . . . . 64.32 109.801 -177.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 mt -65.79 -39.45 90.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.757 -0.656 . . . . 74.5 111.381 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 95.2 m -54.24 -57.72 10.11 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 120.612 0.244 . . . . 64.33 110.753 178.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 -67.54 -31.02 70.83 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 121.069 -0.252 . . . . 75.24 111.264 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 49' ' ' HIS . 0.5 OUTLIER -67.19 -52.39 41.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.54 -0.3 . . . . 74.41 111.52 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.555 ' HB2' HD13 ' A' ' 44' ' ' ILE . 70.3 m-85 -111.47 19.74 17.9 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 112.352 0.501 . . . . 73.31 112.352 -173.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HB2' ' O ' ' A' ' 51' ' ' THR . 8.8 t30 -59.83 -37.74 80.08 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.224 0.466 . . . . 62.24 110.568 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -103.07 14.11 32.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.7 0.762 . . . . 70.41 109.741 176.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.494 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 14.2 ttm180 -138.44 29.14 2.44 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.897 -0.592 . . . . 60.11 109.648 -176.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.861 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -84.5 -146.42 0.0 OUTLIER Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 118.525 -0.75 . . . . 64.3 109.729 176.85 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.861 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 35.1 Cg_exo -2.43 70.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.991 0 C-N-CA 122.351 2.034 . . . . 63.21 112.694 -139.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.902 HG12 ' HB2' ' A' ' 13' ' ' TYR . 4.0 p -116.91 139.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-N 114.553 -1.203 . . . . 74.5 110.396 -165.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.559 ' CD2' HG22 ' A' ' 12' ' ' VAL . 58.6 mt -103.13 110.6 22.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.985 0.421 . . . . 75.05 110.923 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.1 t80 -92.18 120.48 32.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.623 -0.717 . . . . 72.43 109.909 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.97 100.65 9.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.63 . . . . 71.54 110.981 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.54 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.7 t -79.02 98.83 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.336 -0.393 . . . . 54.11 110.291 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 18.1 t-20 168.46 -39.53 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.273 -0.876 . . . . 74.1 108.691 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -125.34 1.87 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.521 -0.763 . . . . 63.12 110.672 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.89 81.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.662 -0.699 . . . . 75.42 111.952 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -173.03 149.6 1.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 73.53 110.043 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 62' ' ' PHE . 1.9 mp0 -88.07 144.93 26.23 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.851 -0.426 . . . . 74.33 109.851 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.4 mt -88.36 -51.33 5.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.014 0.435 . . . . 74.31 110.671 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.7 t -150.79 158.84 44.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 70.24 109.898 -177.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.706 ' HB3' HG23 ' A' ' 60' ' ' VAL . 2.2 p80 -136.17 129.43 31.69 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.661 -0.496 . . . . 64.34 109.661 177.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 73.4 m-85 65.47 121.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 124.18 0.925 . . . . 72.51 110.472 -173.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 72.1 m-85 69.5 171.75 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.193 -0.912 . . . . 61.43 110.767 -175.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.1 tp -123.24 118.3 27.28 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.751 -0.379 . . . . 72.4 111.83 -169.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -92.64 106.24 18.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.915 -0.584 . . . . 53.13 110.026 173.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.1 m -68.52 -39.42 81.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.012 -0.54 . . . . 45.31 111.534 -176.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.46 -41.11 85.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.945 0.402 . . . . 63.55 111.046 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.4 t -66.52 -41.47 88.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 41.22 111.536 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.598 HD11 HD11 ' A' ' 10' ' ' LEU . 8.4 tp -72.55 -31.67 38.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.188 -0.605 . . . . 63.42 110.022 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.58 78.06 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.748 -0.739 . . . . 64.55 111.554 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.14 -29.83 66.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.757 0.313 . . . . 73.33 111.042 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -87.12 -42.26 13.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 74.11 111.556 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.485 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -69.02 -21.18 64.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.065 -0.516 . . . . 74.34 111.95 -174.474 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.326 -0.452 0 N-CA-C 109.628 -0.508 . . . . 44.13 109.628 176.501 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 . . . . . 0 N--CA 1.442 -0.843 0 N-CA-C 109.833 -0.432 . . . . 63.2 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -75.51 177.94 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.341 2.027 . . . . 64.34 111.729 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 9.4 mpt_? -91.93 -179.1 5.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.322 -0.622 . . . . 72.12 109.322 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.755 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.3 tmtp? -142.64 115.17 8.53 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.041 0.448 . . . . 70.03 109.918 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 HD11 ' A' ' 80' ' ' ILE . 79.7 mt -105.66 133.37 50.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.941 -0.572 . . . . 73.2 111.131 178.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.6 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 68.2 t -107.34 127.3 63.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.602 -0.726 . . . . 63.02 109.61 172.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 61' ' ' LEU . 92.4 t -96.64 112.13 28.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 120.953 0.406 . . . . 71.44 110.206 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 1.012 ' HB2' HG23 ' A' ' 60' ' ' VAL . 61.1 m-85 -81.91 111.86 18.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.161 -0.472 . . . . 75.54 109.879 175.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.44 ' O ' HG12 ' A' ' 44' ' ' ILE . . . -120.92 -161.72 11.49 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 110.361 -1.096 . . . . 75.42 110.361 176.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.75 ' HG2' HG11 ' A' ' 58' ' ' VAL . 2.1 ptp180 -164.48 -53.52 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.692 0.746 . . . . 63.34 112.28 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -137.08 -175.19 3.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.606 -0.27 . . . . 71.42 111.068 -169.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -79.0 62.61 3.96 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 116.073 -0.512 . . . . 60.02 113.322 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 m -81.84 134.55 35.43 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.212 -0.662 . . . . 71.12 109.212 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.499 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.0 t60 -68.48 -38.66 81.23 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.504 -0.478 . . . . 55.52 109.836 -176.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 20' ' ' LEU . 23.3 mt -57.37 -31.62 65.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.439 -0.346 . . . . 62.2 111.499 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.443 ' O ' HG13 ' A' ' 25' ' ' ILE . 41.9 t -57.62 -49.5 76.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.452 -0.34 . . . . 75.12 110.426 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.4 pt-20 -70.63 -29.2 65.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.783 0.325 . . . . 71.12 110.436 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 38.2 mt-10 -70.1 -39.73 75.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.985 0.421 . . . . 73.34 110.151 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 89.9 mmm -64.62 -45.49 86.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.048 -0.524 . . . . 72.24 110.004 174.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.2 mt -55.41 -49.64 71.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.261 -0.427 . . . . 71.55 110.285 177.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -60.03 -42.81 95.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.706 0.289 . . . . 75.32 110.9 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.2 m -55.79 -49.08 74.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.235 -0.439 . . . . 64.31 110.757 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.467 HD21 HD11 ' A' ' 61' ' ' LEU . 4.2 mm? -67.25 -38.86 85.86 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.155 -0.475 . . . . 73.11 111.155 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 22.8 mmm180 -61.07 -38.75 87.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 64.12 110.987 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.574 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 93.9 t -68.53 -44.28 83.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.258 -0.428 . . . . 63.52 111.101 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.48 -32.22 73.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.153 0.502 . . . . 63.41 109.732 178.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.459 ' HA ' ' O ' ' A' ' 35' ' ' SER . 35.5 tt0 -64.13 -21.64 66.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.598 -0.728 . . . . 71.32 110.404 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 57.7 mtmt -78.45 -11.84 59.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.585 -0.734 . . . . 71.31 110.943 177.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.18 -48.48 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.168 0.508 . . . . 73.13 109.716 173.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.473 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.7 m -133.81 127.99 33.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.405 -0.816 . . . . 73.25 110.209 -177.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -82.22 131.3 35.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.217 0.532 . . . . 74.13 111.354 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.534 ' HB3' HD21 ' A' ' 84' ' ' LEU . 7.5 p90 -140.21 22.01 2.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.419 -0.81 . . . . 75.25 110.697 177.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 58.2 -176.08 0.08 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.135 -0.484 . . . . 64.21 110.402 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.28 137.03 19.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.759 -0.46 . . . . 62.1 109.759 175.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.723 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 4.2 tp10 -136.71 143.42 43.34 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.139 -0.689 . . . . 73.33 109.139 174.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -127.9 109.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.999 -0.371 . . . . 73.21 109.999 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.519 HD12 HG11 ' A' ' 11' ' ' VAL . 75.9 mt -123.99 109.85 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.309 -0.405 . . . . 54.41 110.881 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -81.53 111.42 17.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.219 -0.446 . . . . 62.55 110.129 176.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.558 HD13 ' HB2' ' A' ' 54' ' ' TYR . 48.4 pt -76.97 -2.01 4.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 71.31 111.153 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 35.3 t70 -61.96 -32.66 73.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.099 -0.501 . . . . 45.22 110.766 -178.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -95.53 0.58 63.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.918 -0.658 . . . . 61.21 112.116 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.68 97.82 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.716 -0.476 . . . . 74.54 109.716 -179.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -58.79 -43.04 90.38 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.735 -0.666 . . . . 54.34 111.276 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -76.08 -30.51 58.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.677 0.275 . . . . 60.45 110.851 -172.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.17 -26.69 53.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.818 0.342 . . . . 70.03 110.71 176.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.503 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 50.5 m -59.89 -37.68 80.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.635 176.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -56.41 -32.56 64.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.165 0.507 . . . . 73.15 110.706 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.15 -57.5 2.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.774 -0.648 . . . . 74.22 111.572 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.6 m-85 -104.51 13.66 31.37 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.116 0.784 . . . . 73.03 113.116 -166.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 51' ' ' THR . 12.6 t30 -52.59 -58.22 7.49 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.341 0.519 . . . . 55.53 111.852 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -90.7 -3.18 57.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.023 0.439 . . . . 64.43 111.3 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.25 74.52 1.24 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.969 -0.752 . . . . 71.43 108.969 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.857 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -100.52 -141.17 0.0 OUTLIER Pre-proline 0 N--CA 1.439 -1.01 0 CA-C-O 118.37 -0.824 . . . . 74.13 109.835 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.857 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 77.2 Cg_exo -9.03 71.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.806 0 C-N-CA 122.778 2.318 . . . . 72.34 114.351 -140.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 1.012 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -103.89 136.26 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.423 -0.808 . . . . 75.34 111.583 -173.373 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.6 HD23 HG22 ' A' ' 12' ' ' VAL . 96.1 mt -93.32 109.22 20.77 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.488 -0.778 . . . . 63.31 110.216 177.082 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.6 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.0 t80 -92.08 125.5 36.79 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.362 -0.835 . . . . 74.31 109.937 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -82.64 104.94 13.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 72.24 110.566 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 85.5 t -70.9 154.29 8.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.567 -0.531 . . . . 74.01 109.567 177.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 87.0 m-20 78.98 -38.03 0.2 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.714 0.806 . . . . 62.23 110.145 -174.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.588 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 51.8 mm-40 -87.13 -33.61 19.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.859 -0.61 . . . . 72.43 111.031 175.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 61.7 66.34 0.85 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.561 0.696 . . . . 65.35 109.905 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.588 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 3.2 ptpp? -160.23 153.51 21.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.294 -0.866 . . . . 75.45 109.992 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 mp0 -87.66 144.19 26.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.34 -0.615 . . . . 71.2 109.34 174.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.2 mt -109.99 -56.51 2.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.023 0.44 . . . . 74.14 111.291 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 46.6 t -140.76 157.49 45.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.897 -0.592 . . . . 72.52 110.472 -169.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 18.3 p-80 -127.63 -171.96 2.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.344 -0.613 . . . . 74.34 109.344 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 13.0 p90 -48.88 144.27 4.74 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.606 0.241 . . . . 71.02 111.548 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 36.3 m-85 71.1 90.15 0.1 Allowed 'General case' 0 C--O 1.236 0.355 0 O-C-N 124.101 0.875 . . . . 65.22 108.827 -165.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.72 126.2 25.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.659 -1.155 . . . . 74.14 111.522 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -75.15 -35.96 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.763 -0.653 . . . . 75.13 110.238 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.37 -48.19 0.68 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.099 -0.955 . . . . 74.23 112.278 178.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.45 -50.6 58.49 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.819 0.303 . . . . 51.12 111.819 -175.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.6 -51.24 75.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 111.782 0.29 . . . . 54.33 111.782 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.793 HD11 HD23 ' A' ' 84' ' ' LEU . 7.1 tp -68.47 -29.57 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 119.834 -0.746 . . . . 74.15 110.298 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.04 -41.35 97.26 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.684 -0.77 . . . . 73.03 111.582 176.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.37 -26.38 68.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.28 0.562 . . . . 62.22 110.633 176.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.428 ' CE2' ' HG2' ' A' ' 8' ' ' ARG . 85.1 t80 -88.0 -50.37 6.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.796 -0.638 . . . . 73.32 111.52 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.793 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -76.52 -39.18 53.74 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.335 0.495 . . . . 73.54 112.335 -172.123 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.7 p . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.778 -0.369 . . . . 74.52 111.345 -173.919 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 35.8 mt-10 . . . . . 0 N--CA 1.449 -0.513 0 N-CA-C 110.665 -0.124 . . . . 74.15 110.665 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 59.3 Cg_endo -69.4 173.62 10.39 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.754 2.303 . . . . 72.35 112.896 -175.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.529 ' HG3' ' HA ' ' A' ' 84' ' ' LEU . 0.5 OUTLIER -108.26 -170.23 1.64 Allowed 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.042 -0.725 . . . . 73.02 109.042 178.093 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 83.6 tttt -146.58 128.68 15.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.081 0.467 . . . . 74.32 110.57 171.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.602 HD11 HD11 ' A' ' 80' ' ' ILE . 80.6 mt -114.96 129.82 56.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 62.41 110.212 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -107.63 126.36 63.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.061 -0.518 . . . . 54.32 109.704 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.575 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 55.8 t -106.09 108.66 25.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.284 0.564 . . . . 63.13 110.058 176.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.674 ' HB2' HG23 ' A' ' 60' ' ' VAL . 96.1 m-85 -81.68 110.62 17.2 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 72.43 109.069 174.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -113.95 171.06 13.58 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.448 -0.882 . . . . 51.22 113.019 -173.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HB2' HG11 ' A' ' 58' ' ' VAL . 45.5 ttt180 -159.32 21.7 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.386 -0.968 . . . . 74.22 108.386 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 62.07 -97.64 0.07 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.248 -1.342 . . . . 60.24 110.191 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.47 -89.05 1.31 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.898 -0.668 . . . . 72.43 113.103 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.3 t -143.07 -167.69 2.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.77 0.319 . . . . 54.12 110.944 -173.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.488 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 22.5 m-70 -69.15 -30.52 68.78 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 113.047 0.758 . . . . 73.14 113.047 -169.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 73' ' ' TYR . 32.4 mt -53.47 -31.29 45.08 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 120.873 -0.331 . . . . 64.11 111.605 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.473 ' O ' HG13 ' A' ' 25' ' ' ILE . 27.1 t -60.14 -48.45 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.492 -0.322 . . . . 72.22 110.912 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.3 pt-20 -73.95 -32.86 63.67 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.754 0.311 . . . . 73.41 110.762 -178.058 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.09 -41.14 96.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.201 0.524 . . . . 75.34 110.06 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.619 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 89.4 mmm -65.27 -46.34 80.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.718 -0.674 . . . . 71.01 110.803 176.287 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.481 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.8 mt -56.55 -48.2 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.335 -0.393 . . . . 64.34 111.497 -178.164 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.17 92.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.068 0.461 . . . . 62.14 110.936 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.6 m -64.67 -39.11 93.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.866 -0.606 . . . . 61.13 111.272 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 24' ' ' MET . 83.3 mt -63.41 -38.72 92.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 74.15 110.95 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.3 mmm180 -62.87 -42.72 99.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.913 -177.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.448 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 68.1 t -71.28 -42.48 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.376 -0.375 . . . . 74.45 110.983 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -66.02 -31.87 73.02 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.048 -0.353 . . . . 71.31 110.048 -179.657 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.44 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -57.99 -28.94 64.86 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.965 0.412 . . . . 75.4 110.907 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 48.4 mtmt -79.86 -12.49 59.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 72.23 110.868 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -103.63 -41.73 5.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 73.43 109.748 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.418 ' HB3' HD12 ' A' ' 84' ' ' LEU . 43.5 m -148.52 119.13 7.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.089 -0.959 . . . . 71.13 109.13 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -72.28 129.58 38.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 64.24 111.239 -176.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 p90 -139.53 21.7 2.53 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.67 -0.695 . . . . 72.11 110.932 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.561 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 22.9 mm-40 59.15 -177.62 0.09 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.94 0.4 . . . . 65.11 110.309 -177.335 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.44 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 7.0 tp -154.3 109.96 3.18 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.485 -0.486 . . . . 64.32 110.476 168.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -114.75 117.87 31.98 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.425 -0.583 . . . . 73.34 109.425 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.7 t -110.84 110.3 31.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.902 -0.59 . . . . 75.12 110.249 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.1 mt -119.6 111.26 32.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.167 -0.47 . . . . 64.33 110.544 -176.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.2 m120 -81.16 113.95 19.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.25 -0.432 . . . . 61.33 110.175 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 51' ' ' THR . 33.8 pt -79.4 0.01 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.926 -0.579 . . . . 73.53 111.964 -173.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.2 -39.52 90.52 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.088 0.471 . . . . 73.34 111.062 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.03 8.73 68.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.777 -0.725 . . . . 65.1 112.753 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -137.71 97.48 3.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.735 0.268 . . . . 74.52 110.557 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 48' ' ' GLU . 3.9 mp0 -54.22 -33.94 59.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.282 -0.417 . . . . 63.14 110.456 178.771 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.3 m170 -57.19 -48.95 77.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.5 -0.773 . . . . 71.23 110.064 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' A' ' 53' ' ' LEU . 90.8 mt -77.84 -26.8 49.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.811 -0.632 . . . . 72.41 111.087 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.591 ' HA ' HD12 ' A' ' 44' ' ' ILE . 85.5 m -56.37 -48.97 75.76 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.296 -0.411 . . . . 42.32 111.24 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -66.39 -31.7 72.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.838 0.351 . . . . 75.53 110.836 -176.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 50' ' ' LEU . 71.0 mt -64.32 -48.49 75.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.888 -0.596 . . . . 61.12 111.314 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 44' ' ' ILE . 81.7 m-85 -119.08 24.84 10.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.43 -0.35 . . . . 72.41 111.905 -172.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 51' ' ' THR . 28.1 t-20 -62.36 120.72 11.57 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.023 -0.271 . . . . 73.15 110.43 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' ASN . 20.8 t70 71.66 -3.49 2.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.752 0.786 . . . . 62.4 110.614 -176.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -115.43 32.91 5.76 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.195 -0.669 . . . . 60.43 109.195 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.782 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -82.51 -140.85 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.662 0 CA-C-O 118.636 -0.697 . . . . 64.34 111.071 -176.424 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.782 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 28.1 Cg_exo -3.89 69.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.729 0 C-N-CA 122.536 2.157 . . . . 63.51 113.278 -139.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.674 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -92.08 131.41 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-N 114.641 -1.163 . . . . 73.44 110.837 -172.215 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 10' ' ' LEU . 2.3 tm? -97.65 101.99 13.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.591 -0.892 . . . . 64.32 108.591 174.111 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.2 t80 -95.29 124.55 39.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.866 -1.061 . . . . 72.53 110.435 -175.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 106.17 17.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.052 -0.522 . . . . 63.12 110.58 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.49 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 58.3 t -67.72 152.85 9.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.558 -0.534 . . . . 71.33 109.558 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 92.8 m-20 76.74 -39.01 0.33 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.528 0.731 . . . . 64.03 110.551 -176.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.86 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 21.2 mm-40 -76.73 -35.98 57.44 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.44 -0.578 . . . . 74.54 109.44 170.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 0.5 OUTLIER 61.51 41.7 12.24 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.89 -1.05 . . . . 74.13 109.479 179.509 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.86 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 1.2 ptpp? -142.15 164.5 30.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.036 -0.984 . . . . 73.1 110.471 -178.069 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -87.47 134.68 33.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.209 -0.451 . . . . 75.34 110.079 174.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.27 -49.99 6.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.255 -0.646 . . . . 71.25 109.255 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.9 t -168.15 165.97 13.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.984 -0.747 . . . . 52.51 108.984 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -144.17 143.99 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 121.202 -0.199 . . . . 63.54 110.661 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.472 ' HB3' HD13 ' A' ' 20' ' ' LEU . 64.3 m-85 74.15 -34.65 0.28 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 124.129 0.893 . . . . 72.23 111.785 -176.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -126.51 165.48 19.05 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.616 -0.513 . . . . 54.14 109.616 -176.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.7 tp -119.71 103.37 9.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.987 0.422 . . . . 72.41 111.017 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.29 96.63 10.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.812 -0.631 . . . . 64.21 109.567 174.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.514 ' HA ' HG22 ' A' ' 80' ' ' ILE . 8.6 m -61.56 -30.1 70.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.674 -0.693 . . . . 72.21 111.472 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -64.18 -42.53 96.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 74.12 110.558 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 71.0 t -75.52 -44.37 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 71.21 111.359 -177.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.602 HD11 HD11 ' A' ' 10' ' ' LEU . 8.0 tp -66.44 -34.32 69.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.358 -0.537 . . . . 72.23 110.269 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.08 91.49 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.882 -0.675 . . . . 74.04 111.779 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.77 -33.38 75.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 64.14 111.038 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -87.35 -40.19 14.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.971 -0.559 . . . . 74.23 111.88 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.604 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -76.8 2.41 14.52 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.699 0.629 . . . . 71.24 112.699 -171.712 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--N 1.319 -0.729 0 N-CA-C 110.224 -0.288 . . . . 63.32 110.224 176.342 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.589 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 12.0 pt-20 . . . . . 0 C--O 1.238 0.484 0 CA-C-O 120.948 0.404 . . . . 55.01 111.126 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 58.9 Cg_endo -71.98 144.74 43.51 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.306 2.004 . . . . 73.1 112.312 -177.139 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.569 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -111.9 138.79 48.04 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.82 -0.807 . . . . 72.5 108.82 175.864 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.586 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 77.9 tttt -88.05 149.79 23.77 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.281 0.562 . . . . 54.51 112.501 -167.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 80' ' ' ILE . 75.2 mt -115.45 131.78 56.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.274 -0.876 . . . . 75.55 110.717 174.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.591 HG23 ' CG2' ' A' ' 64' ' ' VAL . 52.5 t -104.33 133.81 47.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 75.22 109.42 172.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.481 HG22 HD23 ' A' ' 61' ' ' LEU . 21.8 t -98.86 105.7 17.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 C-N-CA 120.165 -0.614 . . . . 75.54 109.426 172.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.75 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 23.6 m-85 -72.13 154.42 41.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 109.189 -0.671 . . . . 73.12 109.189 174.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.581 ' HA2' HG12 ' A' ' 58' ' ' VAL . . . 156.01 -145.27 11.98 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.248 -0.977 . . . . 64.15 111.963 175.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.619 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 8.9 ptm180 -161.03 177.27 10.5 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.447 -0.575 . . . . 73.42 109.447 176.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -77.88 111.48 13.75 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.113 0.482 . . . . 75.23 111.656 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.71 63.43 0.2 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.852 -0.613 . . . . 64.12 112.669 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -148.38 115.34 6.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 71.33 110.814 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.455 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 57.1 t60 -70.91 -39.14 72.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.359 -0.382 . . . . 60.11 111.388 -176.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.441 HD23 ' OE2' ' A' ' 23' ' ' GLU . 15.8 mt -59.72 -31.18 69.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.877 0.37 . . . . 62.22 110.986 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.586 ' O ' HG13 ' A' ' 25' ' ' ILE . 35.3 t -61.04 -45.89 92.93 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.591 -0.522 . . . . 60.03 109.591 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.416 ' O ' ' HB ' ' A' ' 25' ' ' ILE . 30.2 mt-10 -60.73 -47.75 84.9 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.853 -0.612 . . . . 53.22 110.733 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 31.9 mt-10 -63.22 -38.3 90.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.419 -0.809 . . . . 73.1 111.619 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.566 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 45.5 mtp -72.13 -27.94 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.667 -0.413 . . . . 74.4 110.852 177.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 21' ' ' CYS . 67.6 mt -59.12 -45.91 92.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.986 -0.375 . . . . 70.45 109.986 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.97 -41.73 96.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.088 -0.505 . . . . 64.31 110.746 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 m -65.18 -42.38 93.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.009 -0.541 . . . . 73.33 110.719 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 24' ' ' MET . 79.0 mt -67.27 -31.95 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 74.04 111.101 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm-85 -62.11 -44.02 97.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.07 0.462 . . . . 71.54 110.156 175.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.57 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 57.9 t -62.97 -41.46 92.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 53.44 110.492 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -68.1 -33.86 75.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.359 -0.382 . . . . 71.23 110.284 179.349 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.472 ' HA ' ' O ' ' A' ' 35' ' ' SER . 39.8 mt-30 -61.23 -20.86 63.3 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.754 0.312 . . . . 61.31 111.484 177.206 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.8 mtmt -78.74 -17.72 55.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.168 0.509 . . . . 71.42 110.687 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -99.09 -45.98 5.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 74.14 109.563 176.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 25.5 m -144.88 122.83 12.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.367 -0.833 . . . . 71.11 109.559 -178.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -78.68 135.33 37.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.642 0.258 . . . . 72.53 110.651 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 8.2 p90 -146.01 14.23 1.32 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.487 -0.324 . . . . 74.11 111.561 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.559 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 16.7 mt-10 54.9 -174.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.626 0.726 . . . . 53.52 111.203 -175.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 39' ' ' LEU . 6.0 tp -150.85 109.8 3.89 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.83 -0.623 . . . . 73.45 110.351 174.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.586 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 6.2 tp10 -108.7 147.17 32.33 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 75.24 110.225 -178.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -123.65 125.62 71.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.605 -0.517 . . . . 73.45 109.605 176.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 HG11 ' A' ' 11' ' ' VAL . 77.7 mt -135.43 119.87 26.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.919 0.39 . . . . 61.52 110.804 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.619 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 42.6 m-80 -80.66 129.61 34.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 61.14 111.311 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.0 pt -88.56 -15.48 9.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.948 -0.569 . . . . 71.14 110.323 175.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -48.48 -45.67 37.16 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.283 -0.872 . . . . 74.14 112.472 -172.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -87.78 -0.58 83.66 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.654 -0.784 . . . . 64.32 113.276 -176.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 50' ' ' LEU . 51.8 m-80 -110.42 111.82 23.34 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.165 -0.309 . . . . 72.32 110.165 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.28 -47.29 78.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.995 -0.548 . . . . 72.2 111.721 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -70.75 -37.9 73.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.69 0.281 . . . . 74.3 110.475 -174.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 47' ' ' ASN . 69.3 mt -69.22 -33.07 72.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 54.43 110.54 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.475 ' HA ' HD12 ' A' ' 44' ' ' ILE . 94.3 m -57.69 -56.76 17.72 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.188 -0.46 . . . . 51.25 110.475 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.822 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.54 -29.9 68.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.753 0.279 . . . . 75.15 111.753 -178.437 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.6 mt -75.76 -48.13 23.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.466 0.543 . . . . 71.32 112.466 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.534 ' HB2' HD13 ' A' ' 44' ' ' ILE . 51.0 m-85 -122.83 7.87 9.37 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 113.621 0.971 . . . . 70.34 113.621 -167.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.8 t-20 -59.86 -50.42 73.86 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 118.746 0.703 . . . . 74.24 111.766 -176.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -77.12 -20.58 55.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.907 -0.588 . . . . 62.54 111.169 -175.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -128.63 75.15 1.61 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.303 -0.628 . . . . 70.43 109.303 175.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.869 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.19 -142.92 0.0 OUTLIER Pre-proline 0 N--CA 1.438 -1.061 0 CA-C-O 117.823 -1.084 . . . . 64.51 109.335 176.715 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.869 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 94.7 Cg_exo -10.96 101.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.954 0 C-N-CA 122.32 2.013 . . . . 74.31 113.787 -141.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.621 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -129.43 142.82 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 123.427 0.455 . . . . 52.12 110.98 -176.317 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 1.047 ' HG ' ' HD2' ' A' ' 72' ' ' HIS . 22.7 mt -88.11 123.3 32.63 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.094 0.473 . . . . 75.03 111.539 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.509 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 89.7 t80 -105.28 129.9 53.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.083 -0.962 . . . . 74.51 110.296 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.423 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -80.43 104.07 10.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.165 -0.47 . . . . 53.03 110.926 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.591 ' CG2' HG23 ' A' ' 11' ' ' VAL . 46.9 t -80.79 81.78 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.964 0.412 . . . . 75.21 110.668 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 30.5 t-20 172.92 -59.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.124 -0.944 . . . . 64.22 108.963 177.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.05 -7.9 52.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.554 -0.748 . . . . 73.1 110.35 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.4 t70 60.58 78.79 0.27 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.522 0.677 . . . . 74.44 111.395 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -171.42 148.42 2.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.486 -0.779 . . . . 74.11 110.932 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.2 137.69 38.28 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.748 -0.464 . . . . 52.34 109.748 174.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 mt -98.97 -82.41 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.9 0.381 . . . . 73.42 110.447 178.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.402 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 45.6 t -166.37 148.59 6.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 64.05 109.96 -177.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 1.047 ' HD2' ' HG ' ' A' ' 61' ' ' LEU . 4.9 t-80 -146.28 -170.54 3.52 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.483 -0.562 . . . . 75.51 109.483 176.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 55.5 m-85 101.39 -75.74 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.306 1.443 . . . . 72.44 111.412 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -125.56 8.03 7.65 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.174 -0.21 . . . . 72.24 111.272 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.7 tp 71.88 122.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.972 0.795 . . . . 64.43 111.913 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.402 ' OD1' ' HB3' ' A' ' 71' ' ' CYS . 6.1 p-10 -85.56 -40.3 16.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.677 -0.692 . . . . 64.33 110.894 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 61.35 21.17 11.75 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.89 -0.596 . . . . 53.43 111.242 -177.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -127.24 -53.0 1.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.355 0.598 . . . . 73.24 110.354 -175.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.3 t -75.76 -42.93 40.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.514 -0.767 . . . . 72.25 109.904 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.625 HD11 HD23 ' A' ' 84' ' ' LEU . 7.7 tp -66.05 -31.62 54.49 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.239 0 N-CA-C 109.604 -0.517 . . . . 41.02 109.604 174.369 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.6 -30.14 75.9 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.824 -0.703 . . . . 62.21 111.717 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.57 -27.62 51.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.086 0.469 . . . . 73.45 110.505 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.569 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 69.4 t80 -87.35 -45.41 10.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 65.1 111.817 -177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.625 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -74.9 -8.51 56.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.142 -0.481 . . . . 71.11 111.783 -172.96 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.815 -0.439 . . . . 65.24 109.815 175.082 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 109.994 -0.373 . . . . 73.42 109.994 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -86.83 174.4 5.6 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.435 2.09 . . . . 72.13 112.903 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD2' ' N ' ' A' ' 8' ' ' ARG . 2.0 mpt_? -107.58 -176.87 3.19 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.258 -1.015 . . . . 72.14 108.258 176.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.9 tmtp? -150.33 132.34 15.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.415 -0.587 . . . . 72.11 109.415 175.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.587 HD13 HD11 ' A' ' 61' ' ' LEU . 92.7 mt -127.77 138.96 52.92 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 63.22 110.57 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.51 HG22 ' HB3' ' A' ' 40' ' ' GLU . 77.0 t -114.88 137.84 47.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 62.31 110.08 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.608 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -110.14 113.48 44.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.997 0.427 . . . . 73.54 110.18 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.969 ' HB2' HG23 ' A' ' 60' ' ' VAL . 95.2 m-85 -87.11 128.33 35.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.929 -0.767 . . . . 73.52 108.929 174.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.526 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -172.82 -163.15 26.12 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.188 -1.006 . . . . 64.33 111.91 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 13.1 ptm180 -150.69 132.22 14.77 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.369 -0.604 . . . . 73.05 109.369 175.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.49 118.62 7.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.674 -0.694 . . . . 71.03 111.042 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.06 -20.68 1.94 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.38 -0.827 . . . . 64.2 111.601 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.3 p -96.43 128.83 43.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.795 0.331 . . . . 74.24 110.266 177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -69.33 -33.73 73.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.213 0.449 . . . . 74.42 112.213 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 73' ' ' TYR . 20.4 mt -58.61 -32.02 68.6 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.758 0.313 . . . . 75.32 111.258 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.86 -42.38 93.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 65.41 110.265 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.08 -45.49 91.85 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.111 -0.495 . . . . 74.11 110.386 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.452 ' OE2' HD23 ' A' ' 20' ' ' LEU . 45.6 mt-10 -61.89 -40.08 94.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.443 -0.799 . . . . 74.01 111.144 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.535 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.6 mtp -68.72 -49.19 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.241 -0.436 . . . . 62.52 110.698 177.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -58.77 -47.64 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-N 116.717 -0.22 . . . . 70.01 111.432 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -36.68 74.16 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.094 0.473 . . . . 53.23 111.076 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.6 m -69.72 -41.44 75.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.873 -0.603 . . . . 63.42 110.66 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 24' ' ' MET . 86.1 mt -66.66 -34.32 77.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.301 -0.408 . . . . 74.44 111.018 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -61.55 -41.84 97.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.34 111.236 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.71 -37.56 43.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.866 0.365 . . . . 75.14 110.596 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 1.5 mt -64.48 -31.93 73.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 71.2 110.887 178.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.584 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 32.3 mt-30 -52.52 -34.52 50.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.123 -0.49 . . . . 71.31 111.704 176.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -73.86 -23.97 59.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 72.52 111.357 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -93.65 -42.59 9.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.397 0.618 . . . . 73.23 109.965 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB2' HD13 ' A' ' 84' ' ' LEU . 69.9 m -143.54 104.03 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.924 -1.035 . . . . 73.43 109.198 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.7 t-105 -69.27 129.79 40.8 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.898 0.38 . . . . 71.44 111.702 -174.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 30.4 p90 -142.12 18.18 2.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.777 -0.647 . . . . 75.14 111.596 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 59.5 -179.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.032 0.444 . . . . 75.1 110.402 -177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.584 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.9 tp -153.14 132.19 12.6 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 120.099 -0.641 . . . . 72.33 110.808 170.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 7.7 tt0 -136.76 118.19 14.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.551 -0.537 . . . . 72.31 109.551 178.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -107.1 115.82 49.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.525 -0.546 . . . . 71.02 109.525 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.8 mt -115.83 119.69 62.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.775 -175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.539 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 12.0 m-80 -78.23 117.37 19.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 74.43 111.39 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.462 HG22 HD13 ' A' ' 50' ' ' LEU . 23.9 pt -81.01 -7.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 73.33 109.352 174.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -37.69 -46.97 0.94 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.25 -1.341 . . . . 64.15 113.329 -177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.86 32.41 6.93 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.269 -0.967 . . . . 70.33 113.933 -175.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -139.08 100.28 3.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.069 0.435 . . . . 71.31 110.585 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HA ' ' HB ' ' A' ' 51' ' ' THR . 3.7 mp0 -55.38 -33.78 63.74 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.103 0.409 . . . . 73.12 112.103 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -56.89 -45.22 82.74 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.09 -0.337 . . . . 60.32 110.09 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.462 HD13 HG22 ' A' ' 44' ' ' ILE . 80.2 mt -78.64 -39.56 36.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.179 -0.464 . . . . 70.13 110.471 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.501 ' HB ' ' HA ' ' A' ' 48' ' ' GLU . 88.0 m -56.09 -54.03 49.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.194 -0.457 . . . . 54.53 111.679 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -59.06 -30.55 68.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.981 0.42 . . . . 74.21 110.972 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.9 mt -77.05 -53.82 7.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.078 -0.51 . . . . 55.32 111.906 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.451 ' HB2' HD13 ' A' ' 44' ' ' ILE . 59.3 m-85 -116.27 -0.2 12.68 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.487 1.292 . . . . 74.24 114.487 -165.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -59.35 -39.91 84.7 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.843 1.202 . . . . 74.41 111.163 -176.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -84.65 -14.42 48.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.792 -0.64 . . . . 74.24 110.951 178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.412 ' HG3' ' CE2' ' A' ' 73' ' ' TYR . 13.0 ttm180 -143.97 54.12 1.3 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.315 -0.624 . . . . 74.3 109.315 -167.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.584 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.26 -102.66 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.522 0 CA-C-O 118.444 -0.789 . . . . 72.34 111.069 -172.206 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.584 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 16.6 Cg_exo -23.17 75.06 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 122.567 2.178 . . . . 65.04 113.693 -145.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.969 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -102.05 115.51 44.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.719 . . . . 75.43 111.251 -169.229 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.608 HD23 HG22 ' A' ' 12' ' ' VAL . 3.0 tm? -89.19 110.25 21.03 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.572 -0.74 . . . . 61.34 109.587 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -92.25 127.15 37.63 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.111 -0.95 . . . . 72.33 110.693 -176.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.28 95.83 7.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.425 -0.807 . . . . 65.3 111.211 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.527 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 42.2 t -77.63 90.76 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.3 0.572 . . . . 72.21 109.487 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 22.8 t-20 172.19 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.844 -1.071 . . . . 70.1 108.659 -173.542 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -124.05 -2.59 8.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 64.24 109.928 -178.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 58.71 78.74 0.24 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.098 -0.955 . . . . 71.1 112.035 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -174.33 -179.41 1.59 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.39 -0.823 . . . . 75.32 110.332 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -95.09 141.78 28.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.45 -0.341 . . . . 62.22 110.777 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -96.02 -53.9 3.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.388 0.613 . . . . 73.31 109.559 170.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.7 t -156.77 155.47 31.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.312 -0.858 . . . . 71.44 109.374 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 3.6 p-80 -145.09 163.8 33.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.568 -0.287 . . . . 60.25 110.382 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.503 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 62.5 m-85 74.55 -56.63 0.63 Allowed 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.114 0.884 . . . . 71.5 110.951 -174.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -129.93 -161.95 1.16 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.007 -1.108 . . . . 71.14 108.007 -175.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.8 tp -129.85 113.48 14.71 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.079 -0.648 . . . . 54.41 111.886 -175.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -86.09 86.07 7.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.082 -0.71 . . . . 73.32 109.082 169.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.7 m -59.03 -28.23 66.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 64.22 111.381 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.46 -37.4 68.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.193 -0.458 . . . . 75.35 110.908 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 40.5 t -70.89 -46.59 67.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.193 -0.458 . . . . 70.33 110.977 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.512 HD11 HD11 ' A' ' 10' ' ' LEU . 6.9 tp -68.74 -28.18 38.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.346 -0.541 . . . . 64.42 109.992 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.78 -30.64 78.26 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 111.448 -0.661 . . . . 72.52 111.448 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.3 -33.03 64.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.187 0.517 . . . . 64.11 110.377 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -80.41 -51.42 8.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.96 -0.563 . . . . 71.35 111.038 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 35' ' ' SER . 13.3 mt -64.87 -50.93 64.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.707 -0.679 . . . . 62.24 111.516 -177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.576 0.548 . . . . 62.2 111.396 -172.943 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 34.4 mt-10 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 109.748 -0.464 . . . . 73.2 109.748 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 45.3 Cg_endo -62.34 158.67 39.19 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.654 2.236 . . . . 71.23 113.329 -169.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.2 mmp_? -99.2 -164.36 1.12 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.935 -0.765 . . . . 54.43 108.935 175.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.965 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 4.3 tmtp? -149.76 128.87 12.73 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.544 -0.462 . . . . 70.32 110.858 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 37' ' ' PHE . 28.4 mt -116.78 138.67 51.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 64.44 111.294 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 40' ' ' GLU . 41.2 t -124.34 136.41 60.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.701 -0.681 . . . . 63.32 110.131 175.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.579 HG22 HD23 ' A' ' 61' ' ' LEU . 78.4 t -108.35 120.42 59.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.688 -0.486 . . . . 74.44 109.688 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -83.41 97.43 8.95 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.688 -0.486 . . . . 74.52 109.688 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.18 -176.12 14.3 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.018 -1.087 . . . . 52.42 112.696 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.748 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.2 ptm180 -158.28 125.44 4.98 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.896 -0.409 . . . . 74.42 109.896 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 55.3 -154.99 0.28 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.963 -0.562 . . . . 70.43 111.592 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.78 145.37 17.41 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.725 -0.75 . . . . 74.53 112.762 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.407 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 51.2 t -156.28 142.81 18.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.431 -0.581 . . . . 75.23 109.431 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 18.4 m170 -60.38 -48.8 80.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 62.5 111.772 -175.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -34.65 78.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.416 -0.356 . . . . 73.12 110.699 -175.22 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 84.2 m -64.7 -40.63 95.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.39 . . . . 43.13 110.493 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -61.93 -40.5 95.73 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.038 -0.528 . . . . 74.03 110.218 176.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 35.9 mt-10 -64.73 -36.39 84.14 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.726 -0.67 . . . . 71.12 110.942 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.574 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 82.6 mtp -67.26 -44.69 78.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.466 -0.334 . . . . 72.43 110.432 176.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.63 -47.39 82.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.821 0.343 . . . . 74.24 110.897 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.92 87.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.112 -0.495 . . . . 64.03 110.61 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -64.89 -42.33 94.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 71.21 110.887 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 24' ' ' MET . 95.9 mt -59.31 -45.59 90.89 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 116.164 -0.471 . . . . 60.42 110.569 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 28.1 mmm180 -57.73 -42.63 84.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.39 -0.368 . . . . 73.05 111.255 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 98.8 t -64.3 -45.41 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.287 -0.415 . . . . 45.32 111.137 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.95 -32.96 65.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.914 0.388 . . . . 62.41 110.146 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' LEU . 46.8 tt0 -62.78 -26.77 68.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.846 -0.616 . . . . 74.21 110.633 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 47.9 mtmt -63.36 -42.5 98.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.771 -0.65 . . . . 74.21 110.485 173.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -79.06 -37.61 38.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.056 -0.974 . . . . 64.04 110.639 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.632 ' HB3' HD12 ' A' ' 84' ' ' LEU . 46.1 m -145.66 124.68 12.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.527 -0.76 . . . . 75.23 109.628 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -83.72 119.49 24.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.312 0.577 . . . . 74.31 111.041 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.593 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 1.5 p90 -130.96 20.63 4.95 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.536 -0.756 . . . . 75.24 110.926 179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 9.8 mt-10 53.8 -176.83 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.349 0.595 . . . . 75.1 111.027 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.515 HD11 HD13 ' A' ' 28' ' ' LEU . 7.2 tp -152.17 134.9 15.46 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.186 -0.461 . . . . 72.21 110.031 173.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.675 ' HB3' HG22 ' A' ' 11' ' ' VAL . 10.3 tp10 -136.61 143.04 43.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.116 -0.493 . . . . 54.11 110.195 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.2 t -125.75 107.4 17.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.05 -0.722 . . . . 62.24 109.05 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.494 HD12 HG11 ' A' ' 11' ' ' VAL . 62.4 mt -107.86 116.28 50.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.721 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -75.92 106.67 7.63 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.344 -0.844 . . . . 73.33 110.251 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.4 pt -80.17 -9.83 12.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.62 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.59 -42.3 23.61 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.245 -0.889 . . . . 62.03 112.652 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.89 21.06 45.82 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.578 -0.82 . . . . 73.23 113.269 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 19.8 t-20 -129.72 119.62 23.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.028 0.414 . . . . 71.21 110.607 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.23 -20.66 60.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 72.14 111.929 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.402 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 26.8 m80 -77.6 -54.77 6.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.186 0.517 . . . . 74.41 110.363 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.0 mt -65.35 -39.75 92.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.622 -0.717 . . . . 73.32 111.432 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 83.4 m -61.47 -39.57 91.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.988 0.423 . . . . 75.32 110.788 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.07 -31.49 72.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.088 0.47 . . . . 72.34 110.512 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.67 -55.62 4.02 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.741 . . . . 71.32 111.695 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.453 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 49.2 m-85 -109.42 19.55 19.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.104 0.779 . . . . 71.14 113.104 -166.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.638 ' HB2' ' O ' ' A' ' 51' ' ' THR . 60.9 t30 -54.82 -47.48 74.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.175 0.512 . . . . 63.53 111.285 177.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.98 -17.6 56.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.113 -0.494 . . . . 73.41 111.169 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.513 ' HB2' HG23 ' A' ' 60' ' ' VAL . 9.3 ptt180 -128.26 73.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.073 0.464 . . . . 73.33 110.628 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.748 HG11 ' HG2' ' A' ' 15' ' ' ARG . 1.2 m -90.65 -22.6 0.26 Allowed Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 113.399 0.889 . . . . 63.52 113.399 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.505 ' HD3' HG23 ' A' ' 58' ' ' VAL . 3.8 Cg_exo -79.01 49.33 3.12 Favored 'Trans proline' 0 N--CA 1.443 -1.471 0 CA-C-N 120.629 1.26 . . . . 75.0 110.246 164.114 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.513 HG23 ' HB2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.01 131.44 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.198 -0.91 . . . . 64.44 110.16 -175.271 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.579 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -109.34 118.83 37.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.827 -0.624 . . . . 50.01 110.34 -174.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -106.67 136.71 46.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.004 -0.998 . . . . 73.1 110.842 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HG ' ' A' ' 70' ' ' LEU . . . -94.52 111.06 22.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.257 -0.428 . . . . 64.24 111.085 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.965 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 60.9 t -86.33 98.76 7.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.013 0.435 . . . . 71.22 109.994 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.2 t30 177.16 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.076 -1.083 . . . . 64.3 108.076 -176.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -106.16 -11.27 16.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.994 -1.003 . . . . 74.15 109.351 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 67.52 86.99 0.13 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 114.767 -1.106 . . . . 72.14 111.584 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -170.5 157.41 5.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.94 -1.027 . . . . 74.45 109.418 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -82.37 133.88 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.688 0.28 . . . . 73.23 110.399 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.496 ' HG ' ' HB2' ' A' ' 63' ' ' ALA . 53.7 mt -92.59 -46.56 7.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.016 0.436 . . . . 75.12 110.395 178.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.0 t -152.46 157.39 41.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.997 -0.547 . . . . 64.34 111.334 -171.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -128.36 128.82 45.25 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.859 -0.793 . . . . 75.43 108.859 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 59' ' ' PRO . 60.5 m-85 67.39 143.8 0.04 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.949 0.781 . . . . 63.34 112.021 -176.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 57.91 -124.16 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.752 -1.113 . . . . 71.02 110.519 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.0 tp -171.19 110.85 0.33 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.94 -0.304 . . . . 74.52 110.732 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.65 89.6 6.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.937 0.399 . . . . 74.11 110.069 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -57.71 -27.9 63.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.333 -0.849 . . . . 62.33 112.07 -176.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.18 -46.09 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 74.31 110.861 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.09 -44.83 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.51 . . . . 71.03 111.281 -176.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 10' ' ' LEU . 6.7 tp -64.99 -28.23 44.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.512 -0.475 . . . . 45.24 109.802 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.34 -36.27 89.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.75 -0.738 . . . . 61.02 111.662 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.98 -26.58 65.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.088 0.471 . . . . 61.11 110.785 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -87.92 -43.14 12.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 72.31 111.344 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.632 HD12 ' HB3' ' A' ' 35' ' ' SER . 1.3 mm? -76.07 -37.32 58.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.511 0.56 . . . . 75.34 112.511 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 121.156 -0.218 . . . . 55.34 110.934 -177.092 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.486 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 7.4 pt-20 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 110.416 -0.216 . . . . 64.21 110.416 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 92.5 Cg_endo -80.35 167.04 19.79 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.513 2.142 . . . . 74.13 113.155 -172.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.596 ' NE ' ' O ' ' A' ' 85' ' ' SER . 80.7 mtt-85 -107.55 -171.92 1.97 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.419 -0.81 . . . . 72.34 109.522 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 48.8 tttt -149.52 139.43 21.93 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.117 -0.633 . . . . 74.02 112.141 -177.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 80' ' ' ILE . 71.2 mt -113.53 130.29 56.38 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.346 -0.843 . . . . 75.12 110.57 173.048 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.535 HG23 ' CG2' ' A' ' 64' ' ' VAL . 79.8 t -107.07 133.16 52.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.137 -0.69 . . . . 73.44 109.137 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.845 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 11.3 t -96.58 105.56 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 109.574 -0.528 . . . . 73.31 109.574 175.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.535 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 12.8 m-85 -78.23 98.71 5.98 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.933 -0.576 . . . . 75.22 110.256 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.643 ' HA2' ' HD3' ' A' ' 59' ' ' PRO . . . -114.31 -171.57 17.31 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.269 -0.967 . . . . 61.14 112.839 -175.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG2' HG11 ' A' ' 58' ' ' VAL . 10.1 ptm180 -161.97 103.42 1.15 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.766 -0.457 . . . . 72.43 109.766 171.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 73.82 -56.03 0.66 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.209 -0.905 . . . . 72.32 112.689 172.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.41 158.57 26.02 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.283 -0.961 . . . . 72.22 113.544 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.741 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 41.1 t -171.94 128.04 0.6 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.261 0.625 . . . . 74.23 109.8 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -68.0 -42.29 80.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.473 0.178 . . . . 72.34 111.286 -175.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 16.1 mt -61.83 -30.1 70.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.624 -0.262 . . . . 64.21 111.182 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.535 ' O ' HG13 ' A' ' 25' ' ' ILE . 51.4 t -55.93 -50.94 69.35 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.352 -0.24 . . . . 55.25 110.352 177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.24 -39.13 85.61 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.033 -0.531 . . . . 72.31 111.013 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.09 -39.34 89.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.841 -0.618 . . . . 73.43 111.136 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.436 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 15.2 mtp -71.9 -39.18 69.72 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.516 -0.474 . . . . 73.51 110.311 177.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 72.9 mt -54.84 -50.01 64.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 121.347 -0.141 . . . . 54.12 110.759 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.86 84.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.881 0.372 . . . . 74.3 111.17 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -66.96 -44.71 79.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.077 -0.51 . . . . 72.32 110.838 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.42 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 4.2 mm? -67.68 -32.18 72.66 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.32 -0.4 . . . . 72.22 111.31 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 10.0 mmm180 -57.98 -39.02 77.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.446 . . . . 65.13 110.814 178.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.464 ' HA ' ' CE ' ' A' ' 33' ' ' LYS . 80.4 t -67.84 -42.18 85.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.993 -0.549 . . . . 41.23 110.949 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.99 -35.08 77.74 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.808 -0.441 . . . . 75.44 109.808 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 35' ' ' SER . 23.7 tt0 -60.86 -26.59 67.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.584 -0.735 . . . . 63.43 110.656 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.464 ' CE ' ' HA ' ' A' ' 30' ' ' VAL . 54.3 mtmt -74.97 -11.23 60.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.636 -0.711 . . . . 71.11 111.383 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.11 -44.74 4.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 60.12 109.842 173.539 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 17.6 m -131.21 115.92 16.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.055 -177.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -77.24 132.64 38.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.123 0.487 . . . . 61.5 111.344 -177.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 16.6 p90 -139.99 19.0 2.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.708 -0.678 . . . . 55.15 111.062 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 9' ' ' LYS . 10.2 mm-40 60.82 -179.61 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.946 0.403 . . . . 64.24 111.286 -177.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -151.14 110.59 3.98 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.28 -0.637 . . . . 74.44 109.28 173.023 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -121.72 145.03 48.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.513 -0.312 . . . . 54.43 110.324 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.4 117.8 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.961 -0.385 . . . . 71.41 109.961 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -133.43 128.21 54.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.459 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.643 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 98.7 m-20 -83.54 128.71 34.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 63.32 110.46 176.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.2 pt -64.75 -47.51 88.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.208 -0.451 . . . . 70.51 109.994 175.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.43 ' N ' HG13 ' A' ' 44' ' ' ILE . 36.5 t70 44.57 -97.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.33 1.052 . . . . 74.32 113.629 173.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.09 -3.97 63.31 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.931 -0.652 . . . . 73.02 113.44 -171.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -80.93 84.35 6.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.75 -0.463 . . . . 71.21 109.75 178.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -53.27 -32.51 48.94 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 73.4 111.124 -177.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -55.4 -46.95 76.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.838 -0.619 . . . . 72.41 110.457 175.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.5 -39.88 36.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.273 -0.421 . . . . 71.24 110.876 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.609 ' HA ' HD12 ' A' ' 44' ' ' ILE . 6.9 m -56.34 -42.0 77.01 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.369 -0.378 . . . . 73.32 111.809 -177.603 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.22 -34.99 77.54 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.294 0.568 . . . . 72.2 111.095 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.9 mt -78.6 -48.52 14.98 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.442 -0.799 . . . . 74.43 111.33 -176.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.469 ' O ' HG13 ' A' ' 58' ' ' VAL . 62.4 m-85 -114.18 14.79 18.25 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.031 0.752 . . . . 71.32 113.031 -167.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.583 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.5 t-20 -53.45 -54.02 42.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.171 0.442 . . . . 52.4 111.3 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -87.8 -0.48 57.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.44 110.461 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.737 ' O ' HG22 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -108.52 5.26 25.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.716 -0.674 . . . . 73.35 110.647 -172.767 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.91 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 2.6 m -54.85 -171.24 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 114.804 1.409 . . . . 73.14 114.804 -163.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.91 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 17.6 Cg_exo -7.07 82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.428 -2.334 0 C-N-CA 122.507 2.138 . . . . 54.3 113.828 -129.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.845 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -90.53 160.26 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 122.551 0.341 . . . . 63.41 111.327 -171.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.574 HD23 HG22 ' A' ' 12' ' ' VAL . 24.6 mt -97.46 103.03 14.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.281 0.562 . . . . 62.14 109.707 169.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 70.2 t80 -93.68 128.3 39.8 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.056 -0.975 . . . . 71.25 110.777 -177.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.409 ' HB1' ' CE1' ' A' ' 83' ' ' TYR . . . -78.13 102.82 7.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.027 -0.533 . . . . 72.42 110.273 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.535 ' CG2' HG23 ' A' ' 11' ' ' VAL . 61.7 t -66.47 146.5 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.729 -0.669 . . . . 63.22 110.874 -176.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 93.7 m-20 81.0 -31.67 0.11 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.176 0.99 . . . . 73.01 112.729 176.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -98.76 -9.57 24.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 121.17 -0.212 . . . . 74.4 111.505 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 27.8 t70 48.08 73.47 0.21 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.48 0.657 . . . . 73.34 111.642 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -160.26 148.75 16.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 35.42 110.095 -177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -95.95 127.62 42.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.294 -0.632 . . . . 74.41 109.294 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.09 -70.12 0.59 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.622 -0.511 . . . . 65.43 109.622 177.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 50.0 t 178.16 140.38 0.09 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.385 -0.825 . . . . 64.24 108.936 177.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 21' ' ' CYS . 6.8 t60 -144.07 130.82 20.22 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.099 -0.64 . . . . 65.02 110.951 170.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.468 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 2.1 m-85 174.59 -70.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 125.314 1.634 . . . . 74.0 107.718 173.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 41.0 m-85 -114.12 -74.52 0.62 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 73.54 110.118 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 18.0 tp 175.64 141.95 0.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.532 0.333 . . . . 71.42 110.162 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -95.21 -42.52 8.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.387 -0.369 . . . . 65.45 110.617 176.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 m 62.19 20.74 11.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.741 -0.663 . . . . 74.03 111.932 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -139.06 -53.27 0.57 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.615 -0.434 . . . . 70.24 111.092 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.08 -39.25 82.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 73.11 109.71 177.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.58 HD11 HD11 ' A' ' 10' ' ' LEU . 8.1 tp -66.85 -34.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.937 -0.574 . . . . 62.44 109.835 174.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.49 -37.72 94.03 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.63 -0.795 . . . . 73.34 111.242 177.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.22 81.28 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.437 -0.382 . . . . 64.41 110.759 174.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.409 ' CE1' ' HB1' ' A' ' 63' ' ' ALA . 63.7 t80 -67.66 -43.68 79.68 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.087 -0.506 . . . . 65.13 111.72 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -71.26 13.76 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.327 0.491 . . . . 73.33 112.327 -173.378 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.596 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 18.8 m . . . . . 0 C--N 1.322 -0.602 0 N-CA-C 109.775 -0.454 . . . . 74.23 109.775 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.683 -0.488 . . . . 75.41 109.683 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -76.15 157.97 37.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.661 2.241 . . . . 72.35 113.196 -167.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 83' ' ' TYR . 48.7 mtt180 -95.1 -172.02 2.57 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.511 -0.768 . . . . 72.44 109.334 175.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.6 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 87.5 tttt -145.58 140.64 27.55 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.335 0.588 . . . . 73.02 111.685 -177.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.546 HD11 ' CD1' ' A' ' 80' ' ' ILE . 61.5 mt -116.91 129.71 56.24 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.092 -0.958 . . . . 74.21 110.427 174.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -105.82 126.66 61.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 116.017 -0.538 . . . . 74.13 109.784 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.672 HG22 HD23 ' A' ' 61' ' ' LEU . 95.9 t -96.95 114.53 34.14 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.137 -0.483 . . . . 73.33 109.949 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.499 ' HB2' HG23 ' A' ' 60' ' ' VAL . 51.9 m-85 -91.9 122.72 34.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 72.41 110.533 177.45 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.75 166.03 26.33 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 109.818 -1.313 . . . . 62.42 109.818 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -83.44 -68.82 0.68 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 118.414 1.107 . . . . 54.15 110.093 -178.24 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.473 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 1.8 mp0 -121.94 -77.24 0.59 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.2 -0.454 . . . . 44.11 110.114 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -154.04 154.91 25.83 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.389 -0.684 . . . . 52.33 111.389 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.8 t -162.5 145.66 11.32 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.843 -0.428 . . . . 51.12 109.843 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 32.8 m-70 -62.85 -36.19 82.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.696 -0.229 . . . . 65.14 111.215 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -32.39 72.61 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.861 0.363 . . . . 74.25 110.759 178.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 49.8 t -68.35 -42.1 79.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.217 -0.447 . . . . 60.55 109.8 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.37 -40.27 96.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.001 -0.545 . . . . 71.11 111.168 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.0 mm-40 -60.39 -47.06 87.73 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.109 0.481 . . . . 74.0 109.893 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.568 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.1 mtp -61.75 -49.66 75.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.732 -0.667 . . . . 74.44 111.373 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 75.0 mt -55.84 -45.63 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.854 -0.157 . . . . 71.32 111.4 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -37.15 78.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.986 0.422 . . . . 74.13 110.93 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.5 m -69.71 -38.4 76.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.61 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 24' ' ' MET . 82.3 mt -63.76 -39.29 93.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 53.52 110.828 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 1.0 OUTLIER -59.41 -38.29 80.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.097 0.475 . . . . 75.33 110.701 -179.237 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.96 -38.56 72.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.863 -0.608 . . . . 73.34 110.418 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -67.67 -32.65 73.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 74.32 111.438 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.5 mt-30 -59.63 -20.99 59.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.901 0.381 . . . . 63.34 111.432 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.73 -33.1 64.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 62.45 110.992 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.73 -38.64 11.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.171 0.51 . . . . 71.53 110.489 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.681 ' HB3' HD12 ' A' ' 84' ' ' LEU . 36.2 m -147.34 113.78 5.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.827 -0.624 . . . . 72.21 109.983 -177.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.84 128.54 33.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.025 0.441 . . . . 75.22 110.983 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.594 ' HB3' HD21 ' A' ' 84' ' ' LEU . 3.9 p90 -136.61 21.94 3.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.635 -0.711 . . . . 60.23 110.651 177.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.6 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 11.1 mm-40 58.51 -176.8 0.08 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.128 0.49 . . . . 64.05 110.576 -176.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.7 tp -152.62 109.84 3.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.4 -0.363 . . . . 72.14 110.197 170.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 42' ' ' ILE . 33.2 tt0 -121.31 118.73 30.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.046 -0.525 . . . . 63.23 109.593 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -106.9 112.31 39.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.612 -0.514 . . . . 64.43 109.612 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.414 HD11 ' OE2' ' A' ' 40' ' ' GLU . 65.9 mt -111.2 116.66 53.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.025 -0.534 . . . . 73.0 110.727 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.468 ' OD1' ' HA ' ' A' ' 16' ' ' GLU . 28.6 m-80 -76.55 116.98 17.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.809 -0.632 . . . . 64.43 111.06 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 17.9 pt -77.04 -38.65 28.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.965 -0.561 . . . . 74.45 109.83 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.403 ' H ' ' HA ' ' A' ' 15' ' ' ARG . 37.1 t70 32.33 -96.42 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.575 1.172 . . . . 71.13 112.988 -177.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.74 34.79 3.63 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.861 -0.685 . . . . 35.15 112.469 -177.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.418 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 26.5 t-20 -85.18 116.81 23.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.584 -0.525 . . . . 72.14 109.584 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -57.01 -25.05 57.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.849 0.685 . . . . 55.21 112.849 -174.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.418 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 92.5 m-70 -77.8 -58.09 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.354 -0.538 . . . . 72.41 110.768 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.5 mt -78.78 -39.58 35.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.61 0.596 . . . . 64.01 112.61 -172.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.597 ' HA ' HD12 ' A' ' 44' ' ' ILE . 87.9 m -60.69 -48.76 80.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.834 0.35 . . . . 73.14 110.966 -178.073 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -64.43 -29.39 70.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.916 0.389 . . . . 71.15 110.912 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.5 mt -80.09 -50.67 10.01 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.386 0.513 . . . . 75.3 112.386 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -109.04 -1.87 18.58 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.328 1.233 . . . . 74.14 114.328 -165.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -73.19 89.25 1.51 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.916 0.78 . . . . 72.21 112.004 -175.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -136.75 -85.42 0.33 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.308 -0.86 . . . . 72.34 109.177 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -139.59 81.44 1.83 Allowed 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 105.761 -1.941 . . . . 75.55 105.761 171.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.515 HG23 ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -51.09 -84.86 0.0 OUTLIER Pre-proline 0 CA--C 1.507 -0.685 0 CA-C-N 114.435 -1.257 . . . . 63.51 114.365 -157.203 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.515 ' HD3' HG23 ' A' ' 58' ' ' VAL . 51.0 Cg_exo -21.08 78.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.569 0 C-N-CA 122.718 2.279 . . . . 64.01 114.223 -144.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -99.56 133.41 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.592 -0.731 . . . . 75.43 111.267 -170.374 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.672 HD23 HG22 ' A' ' 12' ' ' VAL . 58.1 mt -88.27 106.48 18.24 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.294 0.568 . . . . 72.13 109.694 170.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -91.31 121.97 33.52 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.309 -0.86 . . . . 74.24 109.868 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.5 100.89 6.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.85 -0.614 . . . . 34.32 110.465 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 52.8 t -67.89 161.57 3.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.315 -0.624 . . . . 75.44 109.315 177.315 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 32.1 m-80 79.68 -46.81 0.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.184 0.594 . . . . 74.23 111.618 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -94.3 -26.39 16.61 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.807 0.337 . . . . 73.53 110.258 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 60.99 82.21 0.17 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.316 -0.856 . . . . 72.51 111.791 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -165.11 166.41 19.13 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.261 -0.881 . . . . 72.24 110.112 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -94.17 127.98 40.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 72.44 110.393 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.4 mt -100.91 -82.19 0.46 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.537 0.684 . . . . 61.1 111.733 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 37.8 t -135.8 148.69 48.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.167 -0.924 . . . . 53.42 110.65 -169.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -145.2 163.19 35.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.74 -0.209 . . . . 75.14 111.236 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 82.85 -77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.616 0.969 . . . . 70.44 113.616 171.009 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -114.46 -0.35 13.78 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.737 0.643 . . . . 75.25 112.737 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.6 tp 66.93 108.27 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.673 . . . . 64.01 111.371 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -80.68 -21.8 40.99 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 54.12 110.8 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.7 m 70.82 -54.19 0.66 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.704 0.627 . . . . 75.2 111.809 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -60.39 -45.6 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.005 0.372 . . . . 63.41 112.005 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.13 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 75.44 111.977 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.839 HD11 HD23 ' A' ' 84' ' ' LEU . 5.5 tp -71.84 -34.53 51.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 C-N-CA 120.3 -0.56 . . . . 71.32 109.804 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.35 -35.25 90.69 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.649 -0.786 . . . . 45.13 111.731 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.32 72.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.984 0.421 . . . . 64.44 111.191 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.456 ' CZ ' ' HD3' ' A' ' 8' ' ' ARG . 20.2 t80 -87.76 -47.73 8.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.452 . . . . 71.21 111.712 178.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.839 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -69.46 -37.43 77.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.102 -0.499 . . . . 71.41 111.889 -171.396 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 110.487 -0.19 . . . . 75.31 110.487 -179.329 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.445 -0.69 0 CA-C-O 120.828 0.347 . . . . 70.23 110.935 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.35 152.9 61.35 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.871 2.381 . . . . 62.33 113.282 -173.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' ' O ' ' A' ' 85' ' ' SER . 2.4 ptp180 -115.24 150.04 36.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.264 -0.88 . . . . 74.23 108.64 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.615 ' HG2' ' HG3' ' A' ' 38' ' ' GLU . 47.1 mtpt -100.38 135.96 41.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.643 0.609 . . . . 75.45 112.643 -172.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.714 HD11 HD11 ' A' ' 80' ' ' ILE . 73.5 mt -103.63 130.52 51.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.372 -0.831 . . . . 65.44 110.038 170.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -107.9 128.64 63.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.445 175.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.517 HG22 HD23 ' A' ' 61' ' ' LEU . 86.2 t -96.46 119.5 44.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 109.106 -0.701 . . . . 74.43 109.106 174.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB2' HG12 ' A' ' 60' ' ' VAL . 4.6 m-85 -78.47 97.02 5.55 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.015 0.436 . . . . 73.1 110.811 -179.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.542 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -80.44 160.62 43.98 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.81 -0.71 . . . . 72.31 112.539 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 1.011 ' HB2' HG11 ' A' ' 58' ' ' VAL . 34.9 ttp180 -144.94 -0.67 0.89 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.077 -0.712 . . . . 74.14 109.077 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 59.18 170.66 0.07 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 114.731 -1.122 . . . . 62.22 111.033 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.23 -56.94 4.88 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.808 -0.711 . . . . 52.13 113.632 175.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.17 113.47 6.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.085 0.469 . . . . 73.22 110.97 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -71.46 -28.29 63.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.871 -0.604 . . . . 74.41 111.198 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 73' ' ' TYR . 18.6 mt -54.4 -30.19 51.36 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.624 0.231 . . . . 75.22 111.624 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.417 ' O ' HG13 ' A' ' 25' ' ' ILE . 71.0 m -56.08 -38.74 71.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.671 0.272 . . . . 71.42 110.731 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -71.29 -33.46 69.75 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.731 0.3 . . . . 75.23 110.629 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LEU . 8.3 mm-40 -56.24 -45.05 80.17 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.081 -0.509 . . . . 71.33 110.077 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.616 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.7 mmm -67.0 -41.47 86.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.517 -0.765 . . . . 43.25 110.137 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 21' ' ' CYS . 79.1 mt -56.82 -45.26 83.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 115.938 -0.573 . . . . 71.05 110.805 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.45 87.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.903 0.382 . . . . 75.11 110.69 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -61.59 -42.86 99.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 54.2 110.958 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 24' ' ' MET . 73.8 mt -64.06 -37.6 88.04 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.209 -0.45 . . . . 72.41 110.915 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -61.24 -42.4 98.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.254 -0.43 . . . . 75.03 110.893 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.567 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 97.9 t -71.61 -39.43 69.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.622 178.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HA ' HD23 ' A' ' 31' ' ' LEU . 14.2 mt -66.71 -34.79 78.62 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.377 -0.374 . . . . 72.21 111.443 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.87 -20.99 60.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 72.43 111.37 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.9 mtmt -82.02 -15.86 52.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.04 111.191 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -106.43 -46.2 4.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.481 0.658 . . . . 71.33 109.743 178.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.9 m -141.19 113.22 7.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.884 -1.053 . . . . 72.15 109.319 -175.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -79.22 129.22 34.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.989 0.423 . . . . 64.52 111.7 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' A' ' 84' ' ' LEU . 3.1 p90 -138.27 18.42 2.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.997 -0.547 . . . . 74.4 111.282 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.615 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 12.0 mm-40 57.84 -178.55 0.06 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.329 0.585 . . . . 73.11 111.159 -176.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.8 tp -150.7 117.3 5.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.053 -0.521 . . . . 74.22 110.36 171.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB3' HG22 ' A' ' 11' ' ' VAL . 29.7 tt0 -126.47 123.51 38.0 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.557 -0.747 . . . . 71.25 109.568 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.1 t -104.74 120.25 54.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.472 -0.331 . . . . 43.3 110.153 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 11' ' ' VAL . 75.7 mt -124.71 110.41 24.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.381 -0.372 . . . . 62.52 110.333 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.2 m120 -69.62 122.81 19.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.265 0.555 . . . . 75.23 111.829 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.584 HD13 ' HB2' ' A' ' 54' ' ' TYR . 44.8 pt -86.57 -10.05 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.856 -0.611 . . . . 61.41 110.445 178.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.436 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 5.6 p-10 -73.53 -7.12 50.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.014 0.435 . . . . 74.23 110.32 177.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.36 -2.95 58.83 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.156 -0.778 . . . . 74.33 111.156 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -131.59 97.52 4.25 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.426 -0.583 . . . . 63.11 109.426 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.92 -24.67 67.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.307 0.855 . . . . 54.34 113.307 -169.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -75.27 -41.67 56.73 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.231 -0.588 . . . . 64.12 110.171 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.91 -31.5 72.7 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.51 -0.313 . . . . 75.5 110.594 173.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.479 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 45.5 m -53.43 -57.16 11.62 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.069 -0.514 . . . . 53.45 111.326 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.0 mtt-85 -63.93 -31.28 72.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.025 0.44 . . . . 65.32 111.62 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.7 mt -68.11 -39.86 82.69 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.333 0.494 . . . . 70.43 112.333 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.584 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.5 m-85 -131.47 19.34 4.77 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 112.44 0.533 . . . . 75.42 112.44 -172.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 51' ' ' THR . 45.2 t30 -52.13 -53.35 43.8 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.051 0.453 . . . . 74.41 111.846 -176.67 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -93.25 11.88 26.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.749 -0.659 . . . . 72.5 110.365 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.724 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 72.7 mtm180 -135.49 50.82 2.1 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.773 -0.825 . . . . 75.33 108.773 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.011 HG11 ' HB2' ' A' ' 15' ' ' ARG . 1.4 m -89.27 -24.28 0.29 Allowed Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 114.078 1.14 . . . . 75.15 114.078 -178.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.905 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 8.3 Cg_exo -75.08 52.02 2.97 Favored 'Trans proline' 0 N--CA 1.44 -1.64 0 CA-C-N 121.025 1.402 . . . . 74.01 110.039 165.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.4 OUTLIER -111.46 150.53 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 CA-C-N 114.893 -1.049 . . . . 73.33 110.141 -171.048 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 70' ' ' LEU . 91.6 mt -113.28 122.14 46.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.896 0.379 . . . . 63.03 111.18 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.552 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 91.2 t80 -99.61 125.26 45.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.965 -0.561 . . . . 73.51 109.931 175.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.644 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . . . -84.88 106.95 16.78 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.895 0.379 . . . . 74.41 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.3 t -78.89 93.83 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.04 -0.527 . . . . 65.24 110.093 177.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 33.9 t-20 170.89 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 72.43 109.206 -177.196 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -119.64 -11.63 9.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.596 -0.729 . . . . 74.12 111.026 -176.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 66.69 89.57 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.429 0.633 . . . . 75.44 109.725 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 63' ' ' ALA . 19.3 ptmt -167.9 150.57 5.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 72.54 109.913 -175.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.76 135.41 34.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.753 -0.462 . . . . 64.23 109.753 175.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 3.1 mm? -79.14 -70.99 0.47 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.779 -0.646 . . . . 53.15 110.496 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.492 ' SG ' HD12 ' A' ' 75' ' ' LEU . 8.4 p -152.97 -178.91 7.21 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.388 -0.824 . . . . 71.43 110.101 -178.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -118.38 -170.93 1.98 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.851 -0.613 . . . . 53.43 110.242 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.905 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 21.1 p90 -41.9 135.16 2.43 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 123.769 0.668 . . . . 74.52 111.378 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.486 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 56.6 m-85 71.87 94.13 0.08 Allowed 'General case' 0 C--O 1.231 0.127 0 O-C-N 124.119 0.887 . . . . 73.3 109.353 -173.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.492 HD12 ' SG ' ' A' ' 71' ' ' CYS . 38.4 tp -53.58 123.86 13.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.07 -1.423 . . . . 72.33 113.849 -166.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 71' ' ' CYS . 4.4 m-20 -80.9 94.24 6.45 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.081 -1.081 . . . . 72.11 108.081 167.054 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.1 m -67.85 -36.43 80.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 72.52 111.515 -169.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.55 -43.46 98.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.341 . . . . 54.32 111.228 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.2 -46.92 86.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.159 -0.473 . . . . 62.03 111.598 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.714 HD11 HD11 ' A' ' 10' ' ' LEU . 7.8 tp -66.93 -37.22 78.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.034 -0.666 . . . . 71.42 110.431 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.85 -37.2 93.31 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.578 -0.82 . . . . 53.52 111.661 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -47.46 83.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.879 0.371 . . . . 75.24 110.843 177.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -72.6 -34.25 67.27 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.002 -0.545 . . . . 74.52 111.767 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -84.41 11.05 9.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.409 -0.359 . . . . 75.45 111.859 -174.889 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.774 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.162 -0.681 . . . . 65.43 109.162 172.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.7 pt-20 . . . . . 0 CA--C 1.535 0.373 0 N-CA-C 109.324 -0.621 . . . . 74.3 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 74.4 Cg_endo -73.8 154.51 48.73 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.057 1.838 . . . . 60.43 113.153 -174.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.899 ' NH1' ' O ' ' A' ' 85' ' ' SER . 9.5 ptp180 -109.54 116.22 31.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.746 -0.661 . . . . 73.15 109.602 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 82.7 tttt -74.78 140.12 43.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.877 0.695 . . . . 74.21 112.877 -168.046 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.694 HD11 HD11 ' A' ' 80' ' ' ILE . 32.8 mt -113.08 145.89 40.12 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.203 -0.908 . . . . 74.34 110.736 172.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.9 t -119.73 138.53 50.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.004 -0.544 . . . . 71.31 109.937 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.651 HG22 HD23 ' A' ' 61' ' ' LEU . 65.9 t -113.57 119.97 62.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 N-CA-C 110.165 -0.309 . . . . 74.43 110.165 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 1.024 ' HB2' HG23 ' A' ' 60' ' ' VAL . 63.8 m-85 -83.64 113.87 21.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.526 -0.546 . . . . 75.31 109.526 174.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -124.01 -173.74 13.97 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.617 -0.593 . . . . 74.22 111.617 -177.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' HB2' ' A' ' 45' ' ' ASP . 6.2 ptm85 -159.2 154.89 26.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.821 0.343 . . . . 74.31 110.715 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -73.44 72.62 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.541 -0.754 . . . . 71.12 109.686 174.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.56 61.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.672 -0.695 . . . . 73.45 111.926 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.4 t -172.06 114.37 0.33 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.889 -0.782 . . . . 50.25 108.889 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -70.99 -35.46 72.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.345 -0.389 . . . . 65.14 111.826 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -52.95 -29.2 27.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.929 0.714 . . . . 63.25 112.929 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 62.6 m -54.99 -32.93 62.12 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.623 0.249 . . . . 73.02 111.045 178.179 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -64.15 -50.34 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.381 -0.372 . . . . 63.24 110.401 178.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -55.12 -49.44 71.75 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.518 -0.764 . . . . 54.15 111.241 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.549 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 63.7 mtp -59.09 -54.28 48.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 71.11 111.115 -179.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.69 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 84.1 mt -56.12 -50.59 69.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 73.52 111.407 -177.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -37.81 73.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.958 0.409 . . . . 72.42 111.142 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.4 m -69.11 -43.48 74.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 65.54 110.879 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 24' ' ' MET . 80.4 mt -65.38 -38.38 89.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.03 111.424 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 11.5 mmm180 -58.07 -35.65 71.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 71.34 111.01 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.7 t -77.32 -32.71 19.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.328 -0.396 . . . . 74.44 110.608 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -30.68 66.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.037 0.446 . . . . 75.23 109.859 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.6 mt-30 -59.93 -20.83 59.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.88 -0.6 . . . . 71.41 111.252 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -81.21 -15.54 55.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 63.12 110.855 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -96.97 -49.29 5.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.319 -0.623 . . . . 65.32 109.319 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 17.9 m -140.88 119.8 12.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.025 -0.989 . . . . 72.34 109.366 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -79.26 131.68 36.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.039 0.447 . . . . 74.44 110.618 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' HD12 ' A' ' 10' ' ' LEU . 9.1 p90 -139.15 16.58 2.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.806 -0.634 . . . . 73.4 111.582 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.501 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 15.6 mm-40 59.94 178.5 0.09 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.991 0.424 . . . . 72.24 110.611 -176.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.9 tp -153.19 110.12 3.45 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 120.264 -0.574 . . . . 72.43 110.88 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -115.87 118.63 33.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.97 -0.559 . . . . 72.42 109.97 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -105.4 113.84 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 110.085 -0.339 . . . . 40.11 110.085 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.7 mt -113.05 114.85 48.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.148 -0.478 . . . . 74.44 110.869 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -73.04 118.24 15.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.659 -0.701 . . . . 72.53 111.509 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.524 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.9 pt -86.11 -25.27 6.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.07 -0.514 . . . . 73.33 111.804 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 32.9 t70 -67.49 -23.51 65.49 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.978 0.418 . . . . 73.31 111.55 -172.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.89 19.38 30.11 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.993 -0.622 . . . . 74.24 111.828 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -142.27 119.39 11.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.378 -0.601 . . . . 54.22 109.378 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -55.52 -37.52 68.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 62.42 111.26 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.51 -52.75 9.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.158 -0.473 . . . . 65.13 110.966 -174.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.428 HD23 HD12 ' A' ' 53' ' ' LEU . 48.4 mt -64.11 -33.73 76.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.519 -0.31 . . . . 61.22 111.573 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.57 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 88.1 m -57.85 -53.21 60.77 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 120.845 0.355 . . . . 64.54 110.368 175.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.88 -31.48 72.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.27 -0.423 . . . . 74.31 111.402 -178.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 50' ' ' LEU . 72.1 mt -71.55 -48.35 49.08 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.381 0.512 . . . . 54.5 112.381 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.555 ' CD2' HG21 ' A' ' 60' ' ' VAL . 89.6 m-85 -113.94 8.59 17.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.28 0.844 . . . . 75.32 113.28 -169.492 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.57 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.2 t30 -59.66 135.86 57.81 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.398 -0.521 . . . . 75.04 111.478 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.3 t70 74.86 -30.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 71.44 112.903 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.494 ' HG2' ' OH ' ' A' ' 73' ' ' TYR . 82.8 mtt180 -116.03 37.24 3.73 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 108.364 -0.976 . . . . 75.15 108.364 -175.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.604 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.67 -97.57 0.0 OUTLIER Pre-proline 0 N--CA 1.425 -1.717 0 CA-C-N 115.276 -0.875 . . . . 74.5 110.228 -176.228 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.604 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 65.8 Cg_exo -17.74 75.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 122.535 2.157 . . . . 61.25 113.288 -146.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 1.024 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -111.3 126.16 68.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.916 -1.038 . . . . 70.42 111.699 -165.546 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.651 HD23 HG22 ' A' ' 12' ' ' VAL . 21.5 mt -89.62 112.87 24.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.882 -0.599 . . . . 75.21 110.72 176.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.592 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.0 t80 -91.79 120.28 32.37 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.522 -0.763 . . . . 71.52 109.761 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.87 102.82 11.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.945 -0.57 . . . . 50.32 110.196 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 50.0 t -63.94 146.83 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.145 -0.687 . . . . 64.34 109.145 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 49.8 m-80 85.18 -29.06 0.08 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.157 0.983 . . . . 70.32 111.047 -177.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.699 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 28.0 mt-10 -96.7 -37.01 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.26 -0.176 . . . . 74.51 111.236 176.439 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.592 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 18.2 t70 68.93 77.77 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.791 0.682 . . . . 75.35 109.896 -176.239 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.699 ' HD3' ' HB3' ' A' ' 66' ' ' GLU . 16.4 ptmt -179.77 157.82 0.75 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.36 -0.837 . . . . 73.14 109.674 -174.161 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mp0 -94.9 141.19 28.93 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.566 -0.531 . . . . 73.15 109.566 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 63.4 mt -84.07 -66.16 0.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.447 0.642 . . . . 74.21 110.036 176.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 19.3 t -144.29 170.76 15.39 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.865 -0.791 . . . . 74.51 108.865 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.546 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 1.5 p-80 -144.36 174.65 10.73 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 123.006 0.191 . . . . 62.52 111.503 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.494 ' OH ' ' HG2' ' A' ' 57' ' ' ARG . 18.2 m-85 80.05 -81.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.173 0.989 . . . . 74.25 112.256 178.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.549 ' O ' ' HG2' ' A' ' 24' ' ' MET . 56.0 m-85 -112.37 -84.5 0.58 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 121.023 -0.271 . . . . 62.33 110.846 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.4 tp 178.35 147.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.126 -0.488 . . . . 62.22 110.016 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.525 ' O ' HG22 ' A' ' 80' ' ' ILE . 18.6 t70 -141.12 109.74 5.99 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.498 -0.556 . . . . 73.44 109.498 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 -27.88 69.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.829 -0.623 . . . . 72.43 111.659 -174.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -73.84 -49.53 24.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.967 -0.56 . . . . 65.24 111.446 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.21 -46.97 89.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 45.32 111.796 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.694 HD11 HD11 ' A' ' 10' ' ' LEU . 7.0 tp -69.42 -30.5 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.856 -0.737 . . . . 53.21 109.985 177.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.59 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . -65.42 -19.97 67.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.047 -0.597 . . . . 53.22 111.8 176.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.79 -35.21 60.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.127 0.489 . . . . 63.45 110.231 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -86.53 -40.12 15.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 73.41 111.057 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.595 HD23 HD11 ' A' ' 80' ' ' ILE . 1.7 mm? -85.74 13.51 7.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.4 -0.363 . . . . 71.14 111.404 -178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.899 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 4.4 t . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.502 -0.555 . . . . 75.31 109.502 176.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.448 -0.573 0 N-CA-C 109.911 -0.403 . . . . 74.23 109.911 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.99 121.28 4.43 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.632 2.221 . . . . 62.34 112.477 -175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -102.99 119.08 38.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.426 -0.806 . . . . 70.53 109.741 177.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 57.6 mtpt -73.03 139.0 46.29 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.992 -0.549 . . . . 74.02 112.239 -172.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.597 HD11 HD11 ' A' ' 80' ' ' ILE . 22.3 mt -105.77 119.12 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.286 -0.87 . . . . 72.12 109.923 170.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 40' ' ' GLU . 80.9 t -102.07 129.89 52.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.868 -0.605 . . . . 43.15 109.982 177.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.531 HG22 ' CD2' ' A' ' 61' ' ' LEU . 46.3 t -96.33 107.06 19.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 116.068 -0.515 . . . . 61.33 109.731 176.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 1.069 ' HB2' HG23 ' A' ' 60' ' ' VAL . 20.2 m-85 -81.48 116.89 21.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.396 -0.594 . . . . 63.32 109.396 174.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -147.93 -151.8 5.53 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.286 -0.726 . . . . 62.43 111.286 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.415 ' HE ' ' HB2' ' A' ' 15' ' ' ARG . 5.4 ptm180 -171.26 164.64 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.96 0.41 . . . . 73.4 110.743 176.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.13 131.09 48.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.531 -0.759 . . . . 74.41 110.704 175.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.81 -7.55 55.44 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 23.13 112.863 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -104.53 102.87 12.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.123 0.487 . . . . 73.12 109.827 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -64.61 -33.11 75.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.717 -0.674 . . . . 74.32 110.634 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -59.31 -31.57 69.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.389 -0.369 . . . . 71.32 111.56 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.471 ' O ' HG13 ' A' ' 25' ' ' ILE . 68.3 m -61.04 -42.04 97.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.977 0.418 . . . . 62.54 110.32 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -70.53 -35.13 72.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.02 -0.536 . . . . 63.33 110.47 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.49 -34.34 77.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.733 -0.667 . . . . 73.12 110.686 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.1 mtt -64.54 -43.97 92.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.098 -0.501 . . . . 72.31 110.893 173.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.6 mt -54.68 -53.25 33.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.315 -0.402 . . . . 75.54 110.92 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.18 -31.07 68.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.444 -0.344 . . . . 74.1 111.416 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.7 m -73.33 -46.24 50.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.216 -0.447 . . . . 72.11 110.721 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.478 HD11 HD11 ' A' ' 61' ' ' LEU . 9.2 mp -64.94 -35.91 82.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.197 -0.456 . . . . 75.03 111.604 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -56.61 -34.06 66.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.013 0.435 . . . . 75.32 111.257 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.59 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.7 t -76.79 -40.23 31.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.086 -0.506 . . . . 73.23 110.748 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.423 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -62.81 -34.71 77.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.525 -0.307 . . . . 75.04 111.024 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -53.93 -29.34 41.86 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.49 0.494 . . . . 72.11 111.444 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 54.7 mtmt -77.23 -11.76 59.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.888 -0.596 . . . . 75.34 111.391 -176.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -108.81 -45.84 3.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.527 0.68 . . . . 71.1 109.496 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.562 ' HB3' HD12 ' A' ' 84' ' ' LEU . 44.4 m -137.39 124.08 21.08 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.02 -0.991 . . . . 74.42 109.629 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -84.23 134.25 34.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.065 0.459 . . . . 75.43 111.597 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 9.5 p90 -147.79 18.23 1.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.769 -0.651 . . . . 71.52 110.957 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 27.2 mm-40 58.53 -169.26 0.13 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.561 -0.29 . . . . 72.44 110.468 -177.015 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.62 131.03 13.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.796 -0.446 . . . . 61.12 109.796 175.045 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.603 ' HB3' HG22 ' A' ' 11' ' ' VAL . 5.1 tt0 -146.36 128.23 15.4 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.565 -0.532 . . . . 72.33 109.565 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.2 t -118.9 119.39 60.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.892 -0.41 . . . . 71.34 109.892 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.448 HD12 HG11 ' A' ' 11' ' ' VAL . 71.3 mt -127.7 126.15 66.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.466 -0.334 . . . . 74.03 110.971 -174.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 94.8 m-20 -76.98 126.95 31.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.591 . . . . 71.4 111.094 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' CG1' ' A' ' 58' ' ' VAL . 2.7 pp -79.06 -23.64 12.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 74.52 111.52 -178.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -79.17 -5.48 54.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 72.21 111.067 -175.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.69 -6.58 63.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.791 -0.719 . . . . 71.04 111.762 174.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -127.19 123.92 37.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.653 0.263 . . . . 75.45 110.85 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -50.92 -47.37 60.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 71.22 111.492 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -61.12 -48.88 79.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.386 . . . . 75.5 110.818 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.0 mt -73.23 -31.38 64.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.964 -0.562 . . . . 63.35 111.694 -172.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 55' ' ' ASN . 31.1 m -61.26 -51.69 67.89 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 121.16 0.505 . . . . 73.34 110.334 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -61.11 -30.74 70.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.916 -0.584 . . . . 71.22 111.112 -177.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.77 -34.27 24.82 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.034 0.753 . . . . 72.52 113.034 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -135.85 10.97 3.38 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.443 -0.503 . . . . 70.33 112.283 -165.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 51' ' ' THR . 2.7 p-10 -46.07 -39.09 8.81 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.251 0.834 . . . . 70.12 113.251 -172.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -131.0 21.6 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.641 0.734 . . . . 72.44 110.932 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.1 ttm180 -146.17 44.4 1.24 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.528 -1.286 . . . . 71.13 107.528 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.572 ' CG1' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.2 -98.1 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.52 0 CA-C-N 115.199 -0.91 . . . . 54.21 111.275 -171.885 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.705 ' O ' ' HA ' ' A' ' 72' ' ' HIS . 73.0 Cg_exo -20.17 76.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.29 0 C-N-CA 122.504 2.136 . . . . 74.15 113.646 -145.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 1.069 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -110.42 121.28 62.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 115.24 -0.891 . . . . 65.3 111.179 -170.521 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.531 ' CD2' HG22 ' A' ' 12' ' ' VAL . 38.9 mt -83.25 107.55 15.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.15 -0.477 . . . . 71.2 110.742 176.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -92.33 122.54 34.89 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.829 -0.623 . . . . 64.25 110.418 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.08 102.35 10.96 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.728 -0.669 . . . . 61.42 111.208 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 9' ' ' LYS . 29.4 t -81.15 87.29 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.306 0.574 . . . . 54.03 110.184 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 23.5 t-20 172.32 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.764 -1.107 . . . . 75.12 108.233 -179.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -99.15 -19.54 17.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.879 -1.055 . . . . 75.13 109.862 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.7 t70 67.37 78.41 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.122 -0.945 . . . . 72.12 111.029 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.98 149.32 0.9 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.042 -0.526 . . . . 73.53 110.445 174.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.57 140.09 34.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.941 -0.572 . . . . 73.13 110.415 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -91.6 -81.63 0.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.02 0.438 . . . . 75.32 110.838 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.4 p -122.82 164.45 18.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.113 -0.494 . . . . 43.34 109.85 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.705 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 10.2 p80 -144.83 168.03 21.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.43 0.53 . . . . 54.41 112.43 -176.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 26.2 m-85 74.74 -82.5 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.241 1.016 . . . . 72.35 112.231 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 22.9 m-85 -99.48 -79.51 0.49 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.77 -0.372 . . . . 75.14 110.512 -176.51 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 22.2 tp 171.21 147.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.888 0.743 . . . . 54.35 109.716 176.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -123.68 115.37 21.32 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.675 -0.861 . . . . 71.31 108.675 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.7 p -82.04 -2.63 52.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.981 -0.554 . . . . 74.22 112.364 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -107.43 -39.45 5.64 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.94 -0.304 . . . . 72.21 111.092 -176.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.72 -45.04 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.601 -0.272 . . . . 60.5 110.69 176.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.597 HD11 HD11 ' A' ' 10' ' ' LEU . 7.3 tp -68.34 -31.47 51.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.532 -0.467 . . . . 54.22 110.09 176.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.12 -34.51 86.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.646 -0.788 . . . . 62.44 111.704 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.95 -36.7 72.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.987 0.422 . . . . 62.23 110.492 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -81.34 -47.25 13.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.898 -0.592 . . . . 63.2 111.837 -177.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.562 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.3 OUTLIER -79.11 13.41 1.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.08 0.4 . . . . 71.21 112.08 -172.045 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.765 -0.457 . . . . 65.14 109.765 176.536 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.675 0.274 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -109.71 156.27 20.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.831 0.348 . . . . 0.0 110.285 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -171.58 114.49 0.37 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -63.9 145.75 55.26 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.2 m -81.58 176.54 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.932 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -77.04 145.98 74.53 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.01 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -81.39 173.95 11.09 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.786 2.324 . . . . 0.0 113.044 -171.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -103.75 140.47 37.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.562 ' HD3' ' HB2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -86.66 146.96 26.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 -176.324 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 61' ' ' LEU . 96.3 mt -122.16 137.65 54.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.355 0.598 . . . . 0.0 111.216 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.531 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -119.35 139.62 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.144 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 53.0 t -110.89 114.01 45.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 120.923 0.392 . . . . 0.0 110.133 175.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.761 ' HB2' HG23 ' A' ' 60' ' ' VAL . 71.5 m-85 -82.31 132.57 35.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.165 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.61 -163.58 13.56 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -157.47 121.37 4.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.93 -171.39 0.16 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.475 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.16 98.14 2.21 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.23 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.448 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 38.8 t -108.1 142.36 38.41 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 3.4 m170 -60.28 -44.44 95.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 73' ' ' TYR . 45.0 mt -58.43 -35.18 71.7 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.184 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.505 ' O ' HG13 ' A' ' 25' ' ' ILE . 77.9 m -62.51 -49.99 73.17 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 175.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.65 -44.11 93.67 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.326 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.3 mm-40 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.684 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.413 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.1 mtp -69.09 -37.95 78.7 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.918 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 21' ' ' CYS . 71.5 mt -56.91 -48.92 80.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 175.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -59.53 -41.17 89.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.651 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.7 m -61.42 -46.7 89.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.899 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.486 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 93.2 mt -72.61 -31.31 65.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.381 -177.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -63.61 -39.02 93.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.921 0.391 . . . . 0.0 110.393 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.421 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 91.7 t -65.95 -44.9 92.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.31 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 31' ' ' LEU . 11.9 mt -62.73 -35.6 80.27 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.527 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.697 HE22 ' HB2' ' A' ' 39' ' ' LEU . 40.0 mt-30 -58.68 -21.38 54.27 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -74.69 -30.91 61.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.026 0.441 . . . . 0.0 110.738 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -91.17 -46.52 8.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.095 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.602 ' HB3' HD12 ' A' ' 84' ' ' LEU . 23.2 m -138.5 115.86 11.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.66 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -78.59 131.9 36.92 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.538 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.523 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 3.6 p90 -145.46 13.8 1.39 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.562 ' HB2' ' HD3' ' A' ' 9' ' ' LYS . 15.7 mt-10 57.64 179.86 0.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.516 -175.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HB2' HE22 ' A' ' 32' ' ' GLN . 8.3 tp -152.02 114.74 4.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' HG22 ' A' ' 11' ' ' VAL . 13.2 tt0 -129.64 120.34 25.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.309 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.3 116.86 45.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.954 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.419 HD12 HG11 ' A' ' 11' ' ' VAL . 68.5 mt -114.22 130.15 68.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -175.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -74.98 119.53 19.28 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.623 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.6 pt -88.12 -15.52 9.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.118 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -54.81 -37.26 65.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.372 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.94 -51.12 15.72 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.978 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -82.01 93.81 7.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.018 0.437 . . . . 0.0 110.739 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.91 -18.94 65.67 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.257 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.56 -43.42 98.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 171.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.71 -36.93 73.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.296 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.532 ' HA ' HD12 ' A' ' 44' ' ' ILE . 92.0 m -64.35 -34.85 79.1 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.582 176.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.3 -35.71 81.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.157 0.503 . . . . 0.0 109.866 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.61 -51.02 21.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.399 178.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -108.65 -64.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.888 -170.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 51' ' ' THR . 7.2 t30 55.37 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.349 0.66 . . . . 0.0 112.152 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -84.07 -29.27 26.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 -174.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HD2' ' N ' ' A' ' 57' ' ' ARG . 1.1 mpt_? -95.26 66.87 2.94 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.694 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -85.73 -122.71 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.632 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.751 179.059 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.694 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 88.3 Cg_exo -10.33 66.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.449 2.1 . . . . 0.0 113.409 -142.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.71 127.0 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.971 -167.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 10' ' ' LEU . 2.4 tm? -91.17 103.7 16.35 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.385 -177.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.492 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 79.2 t80 -95.57 136.89 35.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.754 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.54 109.3 20.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 21.4 t -85.72 153.69 3.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 2.6 m-20 71.71 22.09 4.1 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -173.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -157.44 -39.38 0.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.072 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 69.96 60.15 0.26 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.245 172.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.58 158.67 37.52 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.022 176.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -82.93 139.09 33.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.0 mt -105.23 -64.52 1.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.444 0.64 . . . . 0.0 110.09 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 71.0 m -132.14 -177.11 4.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.333 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.612 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 10.9 p80 -144.41 -170.32 3.34 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.784 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.3 p90 -39.67 134.05 1.4 Allowed 'General case' 0 C--O 1.238 0.492 0 O-C-N 124.081 0.863 . . . . 0.0 111.073 175.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.49 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 88.1 m-85 73.31 95.76 0.07 Allowed 'General case' 0 N--CA 1.464 0.229 0 O-C-N 124.474 1.109 . . . . 0.0 109.426 -171.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.5 tp -60.31 128.6 37.51 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.443 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -78.84 -32.71 46.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.1 m 69.98 -51.25 0.64 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.281 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -56.38 -48.04 77.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.986 0.422 . . . . 0.0 111.574 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 33.8 t -64.25 -51.67 65.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.369 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.97 -25.87 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.513 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.647 ' O ' ' O ' ' A' ' 85' ' ' SER . . . -64.35 -44.69 95.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.417 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.94 -24.49 65.19 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.241 0.544 . . . . 0.0 110.818 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -87.9 -57.05 3.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.163 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -71.94 -39.79 69.18 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.7 -170.506 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.647 ' O ' ' O ' ' A' ' 81' ' ' GLY . 32.6 t . . . . . 0 C--N 1.324 -0.524 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -174.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.762 -0.458 . . . . 74.44 109.762 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -93.24 99.77 12.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.052 0.454 . . . . 62.42 111.487 -174.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -104.44 63.27 0.73 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.661 -0.699 . . . . 72.22 109.435 173.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -95.03 -176.61 3.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 74.31 110.67 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -113.9 163.3 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.342 0.592 . . . . 64.45 111.394 -175.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.565 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 11.7 pt-20 -76.61 165.86 49.34 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 114.874 -1.057 . . . . 72.51 110.141 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.1 Cg_endo -73.07 143.42 36.05 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.107 1.871 . . . . 72.33 111.839 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 1.001 ' NH1' ' O ' ' A' ' 85' ' ' SER . 10.8 ptp180 -97.73 171.39 8.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.761 -0.654 . . . . 65.23 109.751 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.573 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.4 tttt -135.79 152.78 51.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.048 0.452 . . . . 75.31 111.748 -174.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.642 HD13 HD11 ' A' ' 61' ' ' LEU . 95.4 mt -122.58 147.52 46.3 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.38 -0.827 . . . . 72.5 110.838 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' A' ' 64' ' ' VAL . 78.0 t -122.91 133.56 68.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.864 -0.607 . . . . 70.22 110.17 175.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 61' ' ' LEU . 72.6 t -105.37 114.32 44.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 120.941 0.4 . . . . 65.15 110.304 175.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.11 117.88 29.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.937 -0.574 . . . . 75.32 110.074 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.28 163.91 26.66 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.271 -0.966 . . . . 74.15 112.56 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.998 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.3 ptm180 -150.29 114.31 5.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.252 -0.277 . . . . 53.13 110.252 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.68 17.93 4.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.715 -0.675 . . . . 71.04 112.549 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.58 64.92 0.36 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.071 -0.585 . . . . 61.3 111.76 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 46.1 t -60.16 -47.68 84.91 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.437 0.295 . . . . 21.41 111.478 -175.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.565 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 t-160 -68.54 -47.25 67.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.519 -0.31 . . . . 71.11 110.546 -175.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -63.12 -36.08 82.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.323 -0.399 . . . . 70.31 111.001 -179.743 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.72 -47.8 82.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 63.3 110.14 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 27.5 mm-40 -56.88 -43.88 81.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.151 -0.477 . . . . 62.15 111.297 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.9 mm-40 -62.96 -48.18 79.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.882 -0.599 . . . . 74.33 110.989 -177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 81.3 mtp -67.46 -38.69 84.83 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.872 -0.331 . . . . 72.21 111.153 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 44.4 mt -57.46 -44.48 84.76 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.516 -0.179 . . . . 72.22 110.516 178.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.12 -43.34 82.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.891 0.377 . . . . 73.01 110.683 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -63.21 -43.33 98.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.051 177.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' MET . 92.7 mt -69.72 -34.36 73.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.932 -0.576 . . . . 74.12 111.112 -178.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 24.2 mmm-85 -60.67 -38.94 86.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.06 0.457 . . . . 74.45 110.576 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.585 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.1 t -70.13 -43.83 78.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.853 -0.612 . . . . 73.42 110.638 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -33.23 74.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.378 -0.374 . . . . 62.4 110.741 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -59.93 -23.92 63.92 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.746 0.308 . . . . 64.44 111.529 176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.1 mtmt -76.68 -17.69 58.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.103 0.478 . . . . 51.31 110.996 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -103.69 -43.14 5.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.699 -0.682 . . . . 72.2 110.423 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.563 ' HB3' HD12 ' A' ' 84' ' ' LEU . 20.0 m -142.94 119.88 11.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.217 -0.901 . . . . 43.42 109.452 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -78.22 131.77 37.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.345 . . . . 75.34 110.913 -177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.605 ' CD1' HD12 ' A' ' 10' ' ' LEU . 6.7 p90 -144.82 16.66 1.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.905 -0.588 . . . . 75.04 111.482 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 36.8 mm-40 58.58 -175.32 0.09 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 73.32 110.974 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.7 tp -151.58 110.71 3.9 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 122.001 -0.437 . . . . 62.32 110.692 172.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . 9.4 tp10 -104.62 141.16 36.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.043 -0.526 . . . . 74.04 109.912 176.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.4 t -127.89 117.29 45.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.454 -0.573 . . . . 71.01 109.454 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.4 mt -128.65 110.62 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.429 . . . . 60.45 111.657 -176.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.4 m120 -68.54 107.41 2.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.896 -0.593 . . . . 54.11 110.007 171.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.433 ' CD1' ' HB2' ' A' ' 54' ' ' TYR . 44.5 pt -82.79 -7.52 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.09 -0.505 . . . . 70.33 111.089 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -59.13 -35.62 73.79 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.429 0.456 . . . . 64.33 111.031 -174.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -82.22 -12.38 80.85 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.574 -0.822 . . . . 74.05 112.873 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -103.9 110.14 22.16 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.073 0.464 . . . . 75.11 110.323 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 15.3 tm-20 -59.08 -44.36 91.87 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.48 -0.782 . . . . 71.32 111.12 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -69.37 -34.96 75.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.578 -0.283 . . . . 73.03 111.442 -175.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.19 -34.71 66.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.88 0.372 . . . . 70.23 110.603 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.53 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 67.7 m -63.35 -31.19 72.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 73.35 110.702 178.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.0 mmm-85 -57.67 -35.8 71.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.368 0.604 . . . . 74.23 110.823 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.8 mt -89.54 -50.14 6.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.498 -0.773 . . . . 64.2 112.401 -175.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.562 ' O ' HG13 ' A' ' 58' ' ' VAL . 20.0 m-85 -108.82 3.97 23.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.332 0.864 . . . . 73.3 113.332 -165.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 51' ' ' THR . 10.4 t30 -43.2 -56.75 3.29 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.237 0.828 . . . . 71.32 113.237 -174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -98.18 1.46 47.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.002 0.371 . . . . 74.3 112.002 -173.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' O ' HG22 ' A' ' 60' ' ' VAL . 96.5 mtt180 -132.96 55.12 1.91 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 75.51 108.897 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.998 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -80.37 -135.07 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 118.825 -0.607 . . . . 74.24 111.978 -172.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.785 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 39.5 Cg_exo -5.45 68.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.476 0 C-N-CA 122.73 2.287 . . . . 64.13 113.474 -139.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -91.09 127.21 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 CA-C-N 115.649 -0.705 . . . . 64.13 110.104 -171.143 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 10' ' ' LEU . 2.7 tm? -93.0 107.3 19.11 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.675 -0.693 . . . . 72.02 109.577 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.502 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 83.6 t80 -98.71 138.22 36.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.077 -0.965 . . . . 65.51 111.305 -173.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.01 112.08 21.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.854 -0.612 . . . . 73.41 110.561 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.574 ' CG2' HG23 ' A' ' 11' ' ' VAL . 38.4 t -73.64 155.0 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.076 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 86.2 m-20 79.02 -49.0 0.43 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.913 0.885 . . . . 65.24 111.718 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -87.88 -20.45 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.734 0.302 . . . . 64.14 110.778 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.502 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 m-20 63.02 82.18 0.19 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.857 -0.611 . . . . 72.13 112.305 175.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? -167.17 139.91 3.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.641 -0.709 . . . . 64.13 110.19 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.34 126.2 30.56 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.153 -0.684 . . . . 72.45 109.153 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB3' HG12 ' A' ' 79' ' ' VAL . 83.6 mt -94.76 -79.21 0.43 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.397 0.618 . . . . 74.21 110.644 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 79' ' ' VAL . 67.3 m -107.78 177.28 4.87 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.358 -0.837 . . . . 71.52 110.281 -175.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 6.6 p80 -131.78 -170.84 2.47 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.298 -0.63 . . . . 74.0 109.298 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.462 ' HD2' ' HD2' ' A' ' 74' ' ' PHE . 34.4 p90 -44.54 132.65 6.12 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 123.737 0.648 . . . . 74.33 110.204 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.462 ' HD2' ' HD2' ' A' ' 73' ' ' TYR . 93.1 m-85 70.78 103.35 0.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 O-C-N 124.026 0.829 . . . . 72.24 109.673 -171.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.5 tp -53.77 121.71 8.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.157 -0.929 . . . . 63.32 111.789 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.414 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 16.4 m-20 -76.83 -22.78 53.09 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.993 -0.549 . . . . 72.3 110.264 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 71.27 -60.4 0.52 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.929 0.892 . . . . 73.52 112.923 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -57.33 -43.77 83.67 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.893 0.378 . . . . 63.31 111.427 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.484 ' HB ' ' SG ' ' A' ' 71' ' ' CYS . 83.5 t -66.61 -42.1 89.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.922 -0.581 . . . . 74.32 111.852 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -71.69 -36.25 58.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 120.085 -0.646 . . . . 64.23 110.244 177.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -58.9 -36.07 85.91 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.469 -0.872 . . . . 43.42 111.39 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.529 0.332 . . . . 50.14 111.265 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -88.08 -36.38 16.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.954 0.407 . . . . 74.23 111.306 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.732 HD23 HD11 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -81.52 14.31 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 72.13 111.914 -175.749 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . 1.001 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 30.7 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.132 -0.485 . . . . 73.14 109.801 174.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 109.978 -0.379 . . . . 72.33 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -156.19 95.81 1.64 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.475 0.655 . . . . 72.4 111.186 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -86.79 76.88 9.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.55 0.69 . . . . 62.24 109.318 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -85.84 98.05 10.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.399 -0.819 . . . . 71.51 110.593 -175.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -90.86 132.4 35.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.739 -0.664 . . . . 61.33 110.073 177.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -137.77 148.28 60.27 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.717 -0.674 . . . . 51.12 110.33 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.84 -179.77 5.07 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.925 2.417 . . . . 72.11 111.722 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HB3' ' OH ' ' A' ' 83' ' ' TYR . 25.9 mmt180 -97.07 -42.64 7.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.089 -0.505 . . . . 74.12 110.18 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.627 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.2 tmtp? 72.03 113.66 0.06 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.011 -0.995 . . . . 70.14 110.873 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.48 HD11 HD11 ' A' ' 80' ' ' ILE . 44.7 mt -106.86 131.56 53.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.509 -0.769 . . . . 73.12 111.014 177.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.4 t -106.79 130.2 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 75.41 109.68 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 61' ' ' LEU . 46.5 t -108.46 108.13 24.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 116.006 -0.543 . . . . 74.2 109.816 177.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.921 ' HB2' HG23 ' A' ' 60' ' ' VAL . 79.2 m-85 -76.22 118.25 18.75 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.965 -0.754 . . . . 72.41 108.965 175.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.87 -161.98 8.98 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.519 -0.848 . . . . 71.4 112.18 -176.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -162.65 -176.52 5.04 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.455 -0.572 . . . . 72.14 109.455 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.25 108.89 2.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.541 -0.3 . . . . 42.01 110.535 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 -144.93 16.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 121.087 -0.578 . . . . 73.22 112.067 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.8 m 70.69 95.76 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.056 0.542 . . . . 63.21 111.883 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.78 -39.59 81.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.633 -0.712 . . . . 72.31 109.897 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.545 HD23 ' OE2' ' A' ' 23' ' ' GLU . 64.6 mt -62.97 -30.94 71.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 73.31 111.794 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.89 -44.28 91.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 62.2 110.561 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -61.71 -43.01 99.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 60.05 110.279 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.545 ' OE2' HD23 ' A' ' 20' ' ' LEU . 39.0 mt-10 -66.0 -39.37 90.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.502 -0.772 . . . . 75.21 110.836 -178.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.422 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 11.6 mtt -61.25 -50.46 72.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 51.24 111.119 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.2 mt -57.21 -46.56 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.374 -0.376 . . . . 64.32 111.19 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.69 -32.58 73.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.914 0.388 . . . . 70.15 111.158 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -72.66 -45.52 58.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.765 -0.652 . . . . 54.44 110.875 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 24' ' ' MET . 96.9 mt -66.39 -32.37 73.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.927 -0.579 . . . . 64.13 111.233 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -56.73 -42.55 79.45 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.959 0.409 . . . . 70.53 110.91 176.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 61.4 t -67.14 -40.63 85.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.901 -0.591 . . . . 62.55 110.998 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.1 mt -70.06 -33.47 71.97 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.013 -0.275 . . . . 74.51 111.479 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -58.75 -21.15 54.73 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.853 0.359 . . . . 75.44 111.327 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.5 mtmt -77.98 -15.48 58.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.423 . . . . 70.54 111.653 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.1 -43.91 4.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.542 0.687 . . . . 73.44 109.445 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.548 ' HB3' HD12 ' A' ' 84' ' ' LEU . 47.3 m -138.51 109.14 6.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.234 -0.894 . . . . 71.43 109.928 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -73.0 126.08 29.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.089 0.471 . . . . 74.33 110.963 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.627 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 4.7 p90 -136.04 18.75 3.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.022 -0.535 . . . . 72.53 111.368 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 59.92 175.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.532 0.682 . . . . 54.02 111.302 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.5 tp -151.26 109.79 3.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.009 -0.541 . . . . 74.12 110.606 173.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -121.22 117.79 27.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 54.24 109.868 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.55 115.26 48.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 109.764 -0.458 . . . . 75.45 109.764 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.2 mt -114.59 122.27 68.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.244 -0.435 . . . . 72.22 111.071 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.46 111.36 4.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.794 -0.639 . . . . 70.44 111.275 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.4 pt -81.0 -21.62 11.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.865 -0.421 . . . . 73.15 109.865 176.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -63.63 -18.95 64.47 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.901 -0.59 . . . . 74.34 111.476 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.87 9.14 59.94 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.691 -0.766 . . . . 52.42 112.253 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -133.09 113.11 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.743 0.306 . . . . 50.35 110.395 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 11.0 mm-40 -58.4 -42.6 87.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 62.32 111.248 -178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -60.5 -41.5 94.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.888 0.375 . . . . 74.31 110.678 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 53' ' ' LEU . 77.1 mt -77.23 -32.09 55.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 64.34 111.019 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.554 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 72.5 m -67.86 -25.63 65.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.316 0.579 . . . . 74.33 110.362 176.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.1 mmt-85 -78.44 -35.12 47.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 55.13 110.143 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.502 HD12 HD23 ' A' ' 50' ' ' LEU . 81.8 mt -70.76 -55.4 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 70.41 111.132 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -108.42 -67.68 0.96 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.006 -0.543 . . . . 70.32 112.065 -170.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 51' ' ' THR . 42.3 t-20 50.86 -87.38 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.984 0.803 . . . . 71.15 111.977 -170.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -89.38 21.86 3.16 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.398 0.618 . . . . 71.33 110.662 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -130.55 59.73 1.65 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.345 -0.843 . . . . 63.34 108.839 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.762 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -92.0 -127.1 0.0 OUTLIER Pre-proline 0 N--CA 1.431 -1.388 0 CA-C-O 117.823 -1.084 . . . . 74.33 109.735 -178.578 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.762 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 80.4 Cg_exo -12.96 71.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 122.504 2.136 . . . . 73.42 114.069 -143.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.921 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -102.11 118.97 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.323 -0.853 . . . . 73.15 111.456 -170.326 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 12' ' ' VAL . 50.8 mt -83.05 103.24 12.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.066 -0.515 . . . . 72.02 110.501 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -91.52 119.39 31.42 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.371 -0.831 . . . . 62.23 109.709 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.03 103.68 5.31 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.506 -0.77 . . . . 30.12 110.523 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.521 HG21 ' HD2' ' A' ' 9' ' ' LYS . 61.0 t -74.61 150.12 7.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 108.977 -0.749 . . . . 71.04 108.977 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.0 t30 67.04 21.94 10.09 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.839 0.828 . . . . 45.04 109.696 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.473 ' HG3' ' HE1' ' A' ' 83' ' ' TYR . 1.0 OUTLIER -152.56 -44.41 0.1 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.31 -0.859 . . . . 75.11 109.091 -178.587 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.7 t70 70.89 81.41 0.16 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.944 -1.025 . . . . 71.13 111.355 176.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -176.34 164.25 2.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.472 -0.786 . . . . 73.33 109.82 175.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -91.66 129.82 37.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.315 -0.402 . . . . 73.01 109.98 172.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.0 mt -84.29 -49.58 8.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.168 -0.678 . . . . 74.34 109.168 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 14.5 t -170.99 167.91 7.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.395 -0.965 . . . . 61.51 108.395 177.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 1.7 p-80 -143.96 147.2 33.6 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.152 -0.219 . . . . 65.32 111.204 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 71.0 m-85 74.97 -44.95 0.56 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 124.174 0.921 . . . . 74.23 111.967 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -125.21 163.74 21.81 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.339 -0.615 . . . . 71.23 109.339 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.7 tp -113.64 101.2 9.1 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.368 -0.378 . . . . 70.21 111.566 -168.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -80.98 93.01 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.738 -0.467 . . . . 64.54 109.738 172.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.506 ' HA ' HG22 ' A' ' 80' ' ' ILE . 14.1 m -56.25 -34.42 66.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.84 -0.618 . . . . 75.33 110.574 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -58.82 -40.59 84.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.545 -0.752 . . . . 73.41 111.134 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 91.2 t -76.8 -49.26 24.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.131 -0.486 . . . . 73.41 111.716 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.506 HG22 ' HA ' ' A' ' 77' ' ' SER . 7.2 tp -63.36 -35.24 71.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 120.737 -0.385 . . . . 65.43 110.694 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.25 -36.19 91.4 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.89 -0.671 . . . . 60.45 111.708 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.16 75.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 64.11 110.751 177.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.473 ' HE1' ' HG3' ' A' ' 66' ' ' GLU . 40.3 t80 -87.18 -50.09 6.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.837 -0.619 . . . . 65.12 111.839 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -63.58 -45.56 89.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.289 -0.414 . . . . 61.3 111.503 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 C--N 1.32 -0.715 0 CA-C-N 116.325 -0.398 . . . . 74.51 110.762 -177.371 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 120.934 0.397 . . . . 74.21 110.789 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -148.29 105.13 3.59 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.341 -0.615 . . . . 60.32 109.341 172.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -80.38 -31.01 37.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.154 -0.475 . . . . 75.05 110.079 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 55.51 85.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.054 -0.976 . . . . 71.41 111.472 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.8 m -102.28 94.53 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.187 0.994 . . . . 71.51 110.952 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 44.3 mt-10 -130.76 123.09 19.92 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-N 114.564 -1.198 . . . . 73.33 109.477 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 88.3 Cg_endo -89.37 -170.75 0.47 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.285 2.657 . . . . 54.42 112.889 -172.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 22.7 mmt180 -103.99 164.87 11.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.634 -0.712 . . . . 62.25 109.576 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.617 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 2.1 tmtp? -141.23 129.52 22.32 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.7 -0.481 . . . . 72.44 109.7 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 ' CD1' ' A' ' 80' ' ' ILE . 57.9 mt -113.84 139.85 48.82 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.079 -0.51 . . . . 63.23 111.598 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.547 HG23 ' CG2' ' A' ' 64' ' ' VAL . 53.3 t -112.26 129.57 67.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.63 -0.714 . . . . 73.22 109.336 170.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.614 HG22 HD23 ' A' ' 61' ' ' LEU . 39.2 t -99.11 114.25 36.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.752 -0.462 . . . . 52.31 109.752 174.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -89.62 126.01 35.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.928 -0.578 . . . . 52.23 110.464 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.05 -163.34 12.93 Favored Glycine 0 N--CA 1.443 -0.862 0 C-N-CA 120.737 -0.744 . . . . 63.44 111.714 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.527 ' HD2' ' OD1' ' A' ' 45' ' ' ASP . 1.2 ptm180 -149.34 160.54 43.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.195 -0.298 . . . . 75.34 110.195 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -62.45 110.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.237 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.4 -19.6 4.53 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.531 -0.842 . . . . 51.21 112.463 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.7 m -74.39 85.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.894 0.378 . . . . 73.53 110.539 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 44.0 m80 -70.86 -30.82 67.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 73.2 110.354 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.59 HD12 ' HB2' ' A' ' 73' ' ' TYR . 2.3 tm? -60.31 -32.12 70.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.775 -0.648 . . . . 72.51 109.779 176.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.754 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 53.9 t -67.76 -38.7 83.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 63.14 110.265 176.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' HD12 ' A' ' 25' ' ' ILE . 50.6 mt-10 -68.0 -32.59 73.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.639 -0.71 . . . . 64.42 110.51 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 18.2 mm-40 -62.89 -39.33 94.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.933 -0.576 . . . . 73.43 110.079 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 78.6 mtp -69.33 -27.29 65.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.562 -0.744 . . . . 72.11 110.936 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 22' ' ' GLU . 74.0 mt -57.01 -43.41 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.462 -0.335 . . . . 72.34 110.17 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.46 97.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 72.23 110.665 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.9 m -60.18 -47.98 83.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.73 -0.668 . . . . 54.41 110.668 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 88.5 mt -62.37 -43.13 99.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.795 -0.639 . . . . 73.43 111.009 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HD2' ' OE1' ' A' ' 32' ' ' GLN . 14.8 mmm180 -55.48 -43.48 75.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 72.22 111.575 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.0 t -65.46 -40.96 89.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.495 -0.321 . . . . 74.54 110.685 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 31' ' ' LEU . 2.2 mt -66.76 -35.14 79.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.637 -0.256 . . . . 71.11 111.014 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.679 HE22 ' HB2' ' A' ' 39' ' ' LEU . 98.9 mt-30 -60.58 -21.38 62.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 63.01 111.503 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -78.05 -13.43 59.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.3 110.799 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -42.23 5.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.96 -0.563 . . . . 70.32 109.985 175.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 31.8 m -141.02 121.03 13.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.448 -0.796 . . . . 64.51 109.869 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -85.45 125.15 32.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.057 0.456 . . . . 74.12 111.199 -175.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.516 ' HB3' HD11 ' A' ' 84' ' ' LEU . 10.5 p90 -133.46 17.07 4.01 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.723 -0.671 . . . . 74.33 111.291 178.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.9 mt-10 58.67 -178.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.418 0.627 . . . . 74.12 111.313 -176.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.679 ' HB2' HE22 ' A' ' 32' ' ' GLN . 4.8 tp -151.25 109.93 3.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.033 -0.531 . . . . 64.15 110.456 173.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.617 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 3.2 tp10 -108.76 143.82 37.39 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.512 -0.551 . . . . 62.11 109.512 178.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.89 108.07 17.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.587 -0.523 . . . . 65.15 109.587 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.496 HD12 HG11 ' A' ' 11' ' ' VAL . 59.5 mt -118.78 118.45 57.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.082 0.468 . . . . 74.44 111.079 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -78.07 115.74 18.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.735 -0.666 . . . . 73.12 109.818 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.588 HG22 ' HB3' ' A' ' 50' ' ' LEU . 26.7 pt -71.74 -34.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.111 -0.495 . . . . 71.12 111.458 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -64.88 98.1 0.26 Allowed 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.37 0.605 . . . . 65.42 110.768 178.062 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 146.72 -37.79 1.17 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.053 -1.219 . . . . 74.01 110.053 -176.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 50' ' ' LEU . 45.6 t-20 -97.65 109.02 21.86 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.527 -0.916 . . . . 74.41 108.527 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -50.62 -34.96 28.17 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 123.878 0.736 . . . . 74.24 111.383 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.71 -49.97 19.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.396 -0.366 . . . . 64.44 110.756 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.588 ' HB3' HG22 ' A' ' 44' ' ' ILE . 32.9 mt -66.42 -34.45 77.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.795 -0.184 . . . . 74.43 111.36 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.1 m -57.78 -56.41 22.27 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.892 -0.323 . . . . 61.23 110.163 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 52' ' ' ARG . 35.0 mmt180 -63.78 -31.55 72.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.594 0.235 . . . . 73.52 111.54 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.0 mt -69.89 -47.15 63.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.4 0.518 . . . . 74.34 112.4 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.494 ' HB2' HG21 ' A' ' 44' ' ' ILE . 96.9 m-85 -117.4 -9.56 10.87 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.33 1.233 . . . . 73.55 114.33 -167.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -76.84 82.97 3.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 119.078 0.854 . . . . 74.32 109.658 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.56 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 16.2 t70 -154.34 -59.42 0.12 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.633 -1.167 . . . . 74.51 109.075 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.56 ' HG3' ' O ' ' A' ' 56' ' ' ASP . 46.7 mtm180 -157.91 90.33 1.06 Allowed 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.28 -1.748 . . . . 72.4 106.28 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.487 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.12 -107.06 0.0 OUTLIER Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 113.473 0.916 . . . . 71.54 113.473 -161.811 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.754 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 96.4 Cg_exo -9.62 72.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.695 0 C-N-CA 122.709 2.272 . . . . 75.33 113.873 -140.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -98.28 135.23 33.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.322 -0.854 . . . . 52.2 110.968 -168.836 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.614 HD23 HG22 ' A' ' 12' ' ' VAL . 34.9 mt -93.52 107.83 19.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 64.41 110.796 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -92.45 123.6 35.87 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.636 -0.711 . . . . 73.23 110.519 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.8 107.14 7.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.803 -0.635 . . . . 74.44 109.553 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.547 ' CG2' HG23 ' A' ' 11' ' ' VAL . 92.3 t -69.78 -31.33 48.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.924 0.392 . . . . 65.32 111.661 -174.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.401 ' HB2' HH11 ' A' ' 8' ' ' ARG . 12.1 m120 -81.85 -44.73 16.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.139 0.495 . . . . 75.44 110.67 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.715 ' HB2' ' HE1' ' A' ' 83' ' ' TYR . 3.5 tp10 -85.55 -20.94 28.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.11 111.138 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 62.23 74.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.664 -0.698 . . . . 75.23 110.56 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.43 ' HE3' ' CG ' ' A' ' 66' ' ' GLU . 19.6 ptpt -172.55 158.08 4.09 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.656 -0.702 . . . . 74.42 110.061 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -84.4 118.79 24.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.0 -0.371 . . . . 71.14 110.0 173.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 82.8 mt -88.01 -68.53 0.75 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.602 0.715 . . . . 65.51 110.788 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.566 ' HB2' HD12 ' A' ' 61' ' ' LEU . 85.6 m -119.21 170.74 8.82 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.697 -1.138 . . . . 64.13 110.41 -173.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -132.65 -172.23 2.86 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.704 -0.68 . . . . 74.01 109.645 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.688 ' HA ' ' SD ' ' A' ' 24' ' ' MET . 21.6 p90 -52.45 138.31 27.7 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.71 -0.478 . . . . 73.35 109.71 175.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 82.4 m-85 70.67 98.59 0.06 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.957 0.786 . . . . 75.23 108.978 -167.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 tp -52.39 119.93 4.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.684 -1.144 . . . . 61.42 112.454 -170.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.525 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 4.7 m-20 -66.21 -31.46 72.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.919 -0.582 . . . . 74.34 109.712 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.2 m 72.91 -54.63 0.69 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.118 -0.946 . . . . 73.4 112.834 172.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -74.63 -48.75 24.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.524 0.202 . . . . 72.44 111.504 -175.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 15.4 t -56.32 -49.35 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 112.412 0.523 . . . . 65.2 112.412 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.68 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -64.6 -30.93 51.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 C-N-CA 120.302 -0.559 . . . . 72.34 110.507 177.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.82 -37.04 93.66 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.83 -0.7 . . . . 73.55 112.021 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.68 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.39 0.614 . . . . 33.44 111.019 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.715 ' HE1' ' HB2' ' A' ' 66' ' ' GLU . 81.3 t80 -84.35 -36.18 22.69 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 61.31 110.798 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.68 HD23 HD11 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -87.84 13.54 10.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.807 -0.633 . . . . 74.5 111.759 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.443 -0.344 . . . . 74.12 110.129 175.861 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.4 mtm . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 109.695 -0.483 . . . . 75.1 109.695 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -85.31 103.29 14.1 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.835 0.35 . . . . 70.15 110.585 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -113.33 -52.03 2.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.26 -0.427 . . . . 72.34 110.808 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.24 145.19 41.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.031 0.443 . . . . 73.14 110.896 -177.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.8 m -111.15 -172.49 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.639 -0.709 . . . . 74.51 111.243 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -87.44 159.22 50.59 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.948 -0.569 . . . . 72.33 110.535 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -80.96 166.54 18.87 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.467 2.112 . . . . 74.55 112.544 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 3.8 mpt_? -95.22 171.68 8.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.968 -0.56 . . . . 72.02 109.882 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 45.8 mtpt -126.56 146.99 49.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.834 0.35 . . . . 65.54 110.829 175.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 80' ' ' ILE . 84.1 mt -120.42 128.24 53.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.814 -0.63 . . . . 75.22 110.1 174.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.534 HG22 ' HB3' ' A' ' 40' ' ' GLU . 55.4 t -108.5 127.41 64.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.896 -0.593 . . . . 55.12 110.305 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.689 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -98.94 108.2 21.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.772 -0.649 . . . . 74.43 109.276 174.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 1.018 ' HB2' HG23 ' A' ' 60' ' ' VAL . 19.0 m-85 -77.93 107.76 10.69 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.576 -0.45 . . . . 54.51 109.886 176.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -130.72 -145.51 5.71 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.946 -0.861 . . . . 32.42 110.946 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' HD11 ' A' ' 44' ' ' ILE . 6.7 ptm180 -174.78 110.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.878 0.339 . . . . 75.41 111.241 177.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 65.06 -87.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.663 -0.699 . . . . 75.32 111.727 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.46 134.52 5.21 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 121.03 -0.605 . . . . 74.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.574 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 44.1 t -153.29 141.29 20.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.918 -0.401 . . . . 74.43 109.918 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -60.22 -34.64 73.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 72.04 110.922 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.569 ' HG ' ' HD1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -73.72 -32.95 64.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.535 . . . . 71.11 111.243 -177.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.574 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 70.7 m -64.28 -42.19 96.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.472 -0.331 . . . . 70.1 110.455 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -54.4 -38.25 65.98 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.222 0.534 . . . . 71.14 110.437 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -74.75 -48.38 25.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.665 -0.698 . . . . 71.23 111.345 -176.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 87.3 mtp -67.13 -42.95 83.57 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.112 -0.235 . . . . 73.01 111.282 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.52 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 71.8 mt -58.74 -48.28 86.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.401 0.143 . . . . 64.13 110.926 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.952 0.406 . . . . 63.22 110.892 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 m -62.91 -43.89 97.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.795 -0.639 . . . . 64.53 111.074 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 92.9 mt -69.03 -35.25 76.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.31 -0.404 . . . . 64.12 111.373 -178.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm180 -57.77 -40.95 80.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.858 0.361 . . . . 62.0 110.864 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.46 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 78.5 t -67.31 -40.12 84.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 62.41 110.867 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.33 -32.06 72.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.69 -0.232 . . . . 72.42 111.23 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 95.3 mt-30 -57.65 -23.01 48.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 72.33 111.339 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -76.58 -19.18 58.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.143 -0.481 . . . . 71.31 111.177 -177.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -105.46 -40.25 5.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.124 0.488 . . . . 70.45 110.545 176.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.575 ' HB3' HD12 ' A' ' 84' ' ' LEU . 19.6 m -140.92 120.38 13.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.915 -0.584 . . . . 61.31 109.756 -178.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.7 t-105 -83.81 123.98 30.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.116 0.484 . . . . 71.14 111.159 -176.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 5.6 p90 -134.88 19.07 3.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.487 -0.779 . . . . 73.23 110.519 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 18.7 mm-40 59.01 -178.23 0.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.923 -0.58 . . . . 75.12 110.302 -176.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.483 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.6 tp -151.95 108.71 3.49 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.619 -0.512 . . . . 71.43 109.619 170.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.534 ' HB3' HG22 ' A' ' 11' ' ' VAL . 19.4 tt0 -120.28 117.9 29.03 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.569 -0.741 . . . . 71.15 109.473 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.06 108.6 25.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 73.54 109.534 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 70.3 mt -110.12 118.01 56.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.92 -0.582 . . . . 60.15 110.001 -177.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 87.4 m-20 -70.19 138.08 51.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.953 -0.567 . . . . 70.13 110.51 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.8 pt -65.89 -25.74 36.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.524 -0.917 . . . . 63.15 108.524 169.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 43' ' ' ASN . 10.6 t70 -57.11 112.01 1.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.589 -1.187 . . . . 63.01 109.548 170.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 120.42 -25.91 7.17 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.049 -0.82 . . . . 62.02 111.049 -174.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.411 HD22 HD12 ' A' ' 50' ' ' LEU . 92.0 m-20 -118.57 106.86 13.07 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.595 -0.52 . . . . 71.21 109.595 175.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.48 -33.79 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.216 -0.447 . . . . 74.32 111.176 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -69.17 -35.57 76.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.453 -0.339 . . . . 74.24 110.516 -176.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.497 ' HB3' HG22 ' A' ' 44' ' ' ILE . 71.5 mt -73.36 -44.28 59.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 71.04 110.887 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.573 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 38.4 m -65.97 -25.24 67.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.037 0.446 . . . . 63.42 110.921 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -38.54 89.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.321 0.581 . . . . 61.12 110.099 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 75.8 mt -90.43 -52.89 4.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.383 -0.826 . . . . 73.1 111.463 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 57' ' ' ARG . 18.9 m-85 -102.74 21.0 16.23 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.758 0.651 . . . . 64.34 112.758 -167.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.573 ' HB2' ' O ' ' A' ' 51' ' ' THR . 9.9 t30 -50.81 -44.24 59.03 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.774 0.321 . . . . 75.21 111.191 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -124.27 24.96 7.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.218 1.009 . . . . 71.31 109.271 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.697 ' HB2' ' HA ' ' A' ' 54' ' ' TYR . 5.0 mmp_? -136.32 36.97 2.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.419 -0.956 . . . . 72.33 108.419 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.6 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -83.16 -108.09 0.0 OUTLIER Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.37 -0.824 . . . . 50.13 110.56 -173.226 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.6 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 31.0 Cg_exo -15.01 68.01 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.481 0 C-N-CA 122.622 2.214 . . . . 74.54 114.124 -144.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 1.018 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -98.99 115.78 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 114.933 -1.03 . . . . 44.43 110.497 -172.323 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.689 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -86.64 105.13 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.584 -0.734 . . . . 72.23 109.528 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -92.28 129.46 38.22 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.959 -1.019 . . . . 75.35 110.58 -176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -84.79 105.74 15.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.521 -0.763 . . . . 73.13 110.683 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.467 HG21 HG23 ' A' ' 11' ' ' VAL . 24.9 t -79.35 84.09 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 65.14 110.586 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.41 ' HB2' ' OH ' ' A' ' 83' ' ' TYR . 0.0 OUTLIER 176.23 -54.46 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.992 -1.004 . . . . 45.43 109.248 178.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -98.0 -12.82 21.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.067 -0.969 . . . . 72.13 111.007 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 61.8 78.1 0.3 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.89 -0.595 . . . . 70.25 109.799 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.58 163.92 6.72 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.515 -0.766 . . . . 64.24 110.213 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -84.58 142.95 29.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.341 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.6 mt -99.88 -32.71 10.86 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.506 -0.553 . . . . 71.21 109.506 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.8 t -173.7 151.74 1.92 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.176 -0.92 . . . . 72.32 109.244 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.66 ' HB3' HG12 ' A' ' 60' ' ' VAL . 2.6 p-80 -135.24 129.96 34.47 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.716 -0.476 . . . . 75.32 109.716 173.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.569 ' HD1' ' HG ' ' A' ' 20' ' ' LEU . 96.8 m-85 66.71 122.15 0.02 OUTLIER 'General case' 0 C--O 1.235 0.341 0 O-C-N 124.239 0.962 . . . . 75.25 110.728 -170.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.47 ' H ' ' CD1' ' A' ' 20' ' ' LEU . 84.5 m-85 65.67 -160.85 0.27 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.077 -1.419 . . . . 74.13 109.603 -176.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.5 tp -136.98 117.34 13.64 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 120.088 -0.645 . . . . 71.45 111.761 -172.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -86.86 87.65 7.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.135 -0.484 . . . . 65.11 109.741 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 m -59.33 -32.3 69.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.809 -0.632 . . . . 74.23 110.753 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -59.16 -43.39 92.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.837 -0.62 . . . . 72.43 111.169 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.4 t -75.33 -46.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 72.53 111.562 -176.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.847 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.99 -30.91 48.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.257 -0.577 . . . . 72.15 110.323 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.23 -29.52 75.51 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.561 -0.828 . . . . 63.33 111.524 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.98 -26.54 36.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.089 0.471 . . . . 73.41 110.508 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.41 ' OH ' ' HB2' ' A' ' 65' ' ' ASN . 63.9 t80 -87.46 -52.55 5.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 73.21 112.157 -177.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.847 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.231 -0.44 . . . . 63.43 111.461 -170.169 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 75.32 110.188 177.04 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.53 -0.544 . . . . 75.21 109.53 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -125.37 101.36 6.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 110.159 -0.312 . . . . 71.32 110.159 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -88.36 102.31 14.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.138 0.494 . . . . 72.33 110.646 -178.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -84.57 100.82 11.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 75.41 110.555 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.0 m -129.83 140.77 48.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.847 -0.615 . . . . 73.31 109.699 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -140.56 143.34 32.27 Favored Pre-proline 0 C--N 1.316 -0.849 0 CA-C-N 116.012 -0.54 . . . . 75.41 109.682 -177.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.8 122.81 5.55 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.401 2.067 . . . . 74.32 111.569 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -110.35 105.08 13.96 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 71.15 110.318 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 1.9 tmtp? -71.47 146.33 48.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.063 -0.971 . . . . 74.04 110.247 -173.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.653 HD12 ' CD1' ' A' ' 37' ' ' PHE . 98.5 mt -124.48 136.85 54.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.073 0.464 . . . . 62.25 111.347 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.717 HG23 HG21 ' A' ' 64' ' ' VAL . 39.3 t -114.48 135.72 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.89 -0.595 . . . . 72.03 110.17 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.667 HG22 HD23 ' A' ' 61' ' ' LEU . 98.5 t -107.54 106.84 21.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.565 -0.531 . . . . 74.42 109.565 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.862 ' HB2' HG23 ' A' ' 60' ' ' VAL . 89.7 m-85 -76.99 122.98 25.67 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.764 -0.828 . . . . 74.22 108.764 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -157.51 -169.26 21.06 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 119.503 -1.332 . . . . 62.41 112.922 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.828 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.3 ptm180 -154.6 144.58 21.77 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.848 -0.797 . . . . 73.22 108.848 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -75.83 87.92 2.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.046 0.451 . . . . 75.33 110.037 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.08 32.1 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.551 -0.749 . . . . 51.12 111.511 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 p -170.58 138.99 1.53 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.69 -0.485 . . . . 74.31 109.69 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -70.68 -29.89 66.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 54.55 112.127 -172.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.422 HD12 ' CD1' ' A' ' 73' ' ' TYR . 26.4 mt -55.78 -30.4 61.23 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.489 0.551 . . . . 72.12 112.489 -175.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' HG13 ' A' ' 25' ' ' ILE . 76.1 m -54.5 -50.5 67.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.327 . . . . 63.21 110.863 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.75 -35.59 81.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.115 -0.493 . . . . 61.12 110.834 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -68.76 -44.1 74.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.669 -0.696 . . . . 71.53 111.309 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.6 mtp -65.65 -37.53 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.925 -0.31 . . . . 75.31 111.157 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.0 mt -57.71 -52.38 58.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 110.143 -0.317 . . . . 63.11 110.143 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.44 89.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 60.13 110.879 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.8 m -59.15 -42.87 91.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.92 -0.582 . . . . 71.33 111.106 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.2 mt -68.45 -42.53 78.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 71.23 111.046 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -60.84 -26.44 67.35 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.97 0.359 . . . . 74.11 111.97 -175.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.79 -44.83 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.654 0.264 . . . . 75.52 110.602 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.87 -26.01 53.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.343 0.592 . . . . 74.13 109.82 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -60.98 -20.54 62.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.4 -0.818 . . . . 72.12 110.366 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -71.95 -16.83 62.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.828 -0.624 . . . . 75.04 111.514 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.35 -39.02 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.49 -0.323 . . . . 70.25 111.153 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.412 ' HB3' HD12 ' A' ' 84' ' ' LEU . 18.2 m -126.97 135.98 51.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.505 -0.316 . . . . 64.0 111.056 -174.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -84.13 110.93 18.88 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.224 -0.443 . . . . 72.34 110.478 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.896 ' HB3' HD11 ' A' ' 84' ' ' LEU . 32.4 p90 -132.57 6.18 4.06 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.93 -0.577 . . . . 72.04 110.744 176.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.582 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.8 mt-10 59.77 -177.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.675 . . . . 64.32 111.546 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -149.19 120.02 7.59 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.994 -0.548 . . . . 63.05 110.017 175.858 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.694 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 23.3 tt0 -131.29 118.03 19.78 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.822 -0.436 . . . . 62.42 109.822 177.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -103.9 114.24 42.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 109.543 -0.54 . . . . 63.23 109.543 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 HG11 ' A' ' 11' ' ' VAL . 62.6 mt -112.62 116.89 53.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.256 0.55 . . . . 74.43 111.04 -176.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -71.75 107.45 4.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 62.5 110.582 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 29.7 pt -76.34 -10.73 13.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.286 0.565 . . . . 75.34 109.62 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -46.81 -39.2 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.421 -1.263 . . . . 74.24 112.651 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.5 20.99 48.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.526 -0.845 . . . . 75.25 112.9 -176.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.488 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 15.6 t-20 -137.26 110.36 7.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.882 0.341 . . . . 71.5 110.564 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -59.02 -33.78 71.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.334 -0.394 . . . . 63.35 111.807 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 66.2 m170 -66.21 -52.19 50.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 73.45 110.404 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.35 -38.97 88.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.87 -0.604 . . . . 73.43 110.958 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.632 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 94.9 m -62.05 -40.97 97.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.872 0.367 . . . . 74.44 111.243 177.535 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 70.1 mtp85 -75.53 -31.98 60.3 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 122.077 -0.39 . . . . 63.13 110.576 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -64.12 -51.43 64.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 53.34 110.978 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -109.61 -72.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.067 -0.515 . . . . 72.02 111.596 -173.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.632 ' HB2' ' O ' ' A' ' 51' ' ' THR . 39.8 t-20 51.02 -81.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.691 0.797 . . . . 64.21 111.725 -169.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -91.23 8.6 35.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.686 0.755 . . . . 71.22 110.104 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.11 46.89 1.1 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.203 -0.666 . . . . 72.41 109.203 169.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.828 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -81.86 -142.24 0.0 OUTLIER Pre-proline 0 N--CA 1.447 -0.6 0 CA-C-O 118.578 -0.725 . . . . 72.25 110.653 -178.781 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.815 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 82.7 Cg_exo -8.01 71.38 0.0 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.885 0 C-N-CA 122.663 2.242 . . . . 51.52 113.885 -139.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.862 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.77 113.48 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.453 -0.794 . . . . 53.35 110.136 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.667 HD23 HG22 ' A' ' 12' ' ' VAL . 2.5 tm? -83.37 106.75 15.38 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.765 -0.652 . . . . 64.35 109.355 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -100.57 134.4 43.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.82 -1.082 . . . . 75.44 110.797 -175.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.57 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -84.91 106.19 16.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.841 -0.618 . . . . 75.41 110.943 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.717 HG21 HG23 ' A' ' 11' ' ' VAL . 49.1 t -86.31 91.93 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.937 0.399 . . . . 72.11 111.067 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 40.7 t-20 168.97 -57.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.666 -1.152 . . . . 42.13 108.21 176.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -91.21 -18.87 23.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.549 -0.75 . . . . 73.24 110.499 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.1 t70 68.05 87.02 0.13 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.689 -0.687 . . . . 71.24 110.002 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -167.37 165.53 14.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.312 -0.858 . . . . 75.1 109.467 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -108.99 137.8 46.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.892 -0.41 . . . . 74.03 109.892 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 61' ' ' LEU . 18.9 mt -96.79 -70.47 0.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.017 0.437 . . . . 74.0 110.869 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 21.4 p -143.91 160.63 40.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 51.44 110.189 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.54 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 24.2 p80 -139.54 144.47 37.88 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.159 -0.216 . . . . 71.03 110.999 179.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 6.6 m-85 74.54 -43.79 0.54 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.831 0.852 . . . . 72.44 112.81 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -135.56 137.0 41.59 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.202 -0.666 . . . . 72.01 109.202 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 17.8 tp -89.71 110.71 21.58 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.049 0.452 . . . . 60.31 110.525 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -64.97 -28.41 69.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.805 -0.634 . . . . 61.02 111.087 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.0 m 75.77 -40.99 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.804 -0.635 . . . . 72.31 112.143 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -76.6 -45.97 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.071 -0.393 . . . . 62.21 110.455 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.3 t -55.31 -49.83 69.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.171 -0.468 . . . . 72.24 111.68 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.525 HD11 HD11 ' A' ' 10' ' ' LEU . 7.2 tp -66.83 -34.75 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 64.32 110.397 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.24 -22.84 77.57 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.879 -0.677 . . . . 63.52 111.972 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.16 -32.76 56.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.166 0.507 . . . . 72.22 110.173 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.441 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 85.2 t80 -87.09 -38.97 16.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.637 -0.71 . . . . 61.01 111.804 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.896 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -79.17 4.02 16.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.637 0.606 . . . . 74.41 112.637 -171.453 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.606 -0.516 . . . . 71.35 109.606 173.293 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.427 ' HB3' ' HB3' ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 108.81 -0.811 . . . . 71.01 108.81 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -53.58 -51.61 62.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.861 0.319 . . . . 64.12 111.861 -176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -122.07 70.12 0.96 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.396 0.617 . . . . 52.11 110.643 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 15.9 pt20 -90.79 160.57 15.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.74 -0.664 . . . . 73.3 109.588 176.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.465 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 31.8 m -121.52 155.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 72.13 112.497 -170.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 5' ' ' VAL . 1.2 mm-40 -145.83 160.4 43.96 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 114.673 -1.148 . . . . 70.21 108.609 177.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB3' ' HD1' ' A' ' 36' ' ' TRP . 87.3 Cg_endo -76.66 158.93 35.57 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.02 1.814 . . . . 64.11 111.827 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.696 ' NH2' ' O ' ' A' ' 85' ' ' SER . 44.9 mtt180 -81.21 -21.64 39.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.418 -0.356 . . . . 70.04 111.436 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 3.9 tmtp? 64.34 108.52 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.933 0.771 . . . . 62.43 112.828 170.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 80' ' ' ILE . 32.0 mt -105.43 133.01 50.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.618 -0.719 . . . . 52.21 110.811 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.6 t -109.85 131.69 60.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.687 -0.688 . . . . 64.52 109.84 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.52 HG22 ' CD2' ' A' ' 61' ' ' LEU . 62.3 t -99.31 109.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.829 -0.434 . . . . 71.34 109.829 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.956 ' HB2' HG23 ' A' ' 60' ' ' VAL . 12.9 m-85 -84.33 120.33 26.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.138 -0.483 . . . . 71.52 110.124 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.485 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -138.87 170.5 23.99 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.157 -0.777 . . . . 63.02 111.157 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.413 ' HG2' HG21 ' A' ' 58' ' ' VAL . 12.2 ptm180 -135.72 123.66 22.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.12 0.46 . . . . 75.23 110.813 178.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 61.27 -81.53 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.262 0.976 . . . . 60.32 112.454 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.82 139.36 6.01 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.673 -0.775 . . . . 44.12 112.203 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.2 m -148.84 115.71 6.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.1 -0.333 . . . . 73.02 110.1 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -56.48 -46.84 80.25 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.983 0.421 . . . . 63.11 111.098 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.568 HD11 ' H ' ' A' ' 74' ' ' PHE . 1.9 tm? -63.98 -32.15 73.59 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.767 -0.651 . . . . 63.12 110.707 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.581 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 42.1 t -67.33 -38.68 85.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.535 -0.302 . . . . 62.23 110.557 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.21 -39.92 73.24 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.493 0.663 . . . . 75.4 110.22 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -69.89 -34.18 73.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.085 -0.961 . . . . 54.22 110.843 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.494 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 73.3 mtp -68.0 -42.18 81.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 43.43 109.982 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 79.7 mt -55.83 -46.12 79.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.748 -0.66 . . . . 55.12 110.728 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.01 98.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.509 . . . . 73.34 110.91 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 m -60.52 -39.09 86.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.291 0.567 . . . . 73.51 110.717 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.537 HD11 HD21 ' A' ' 61' ' ' LEU . 84.3 mt -71.24 -33.8 70.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.999 -0.546 . . . . 63.3 111.684 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.14 -40.73 96.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.362 . . . . 72.42 110.213 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 63.0 t -66.76 -43.65 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.22 110.858 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.457 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.0 mt -63.03 -33.66 75.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.69 -0.232 . . . . 70.33 111.27 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.534 ' OE1' ' HB2' ' A' ' 39' ' ' LEU . 17.6 mt-30 -58.94 -25.27 63.35 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.876 0.324 . . . . 63.23 111.876 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -75.37 -19.39 59.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.077 0.465 . . . . 74.54 110.734 -179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -101.33 -44.68 5.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 72.34 109.689 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 13.5 m -139.22 120.35 14.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 64.23 109.582 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.434 ' HD1' ' HB3' ' A' ' 7' ' ' PRO . 56.5 t-105 -83.61 124.01 30.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.391 0.615 . . . . 64.51 111.226 -174.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.53 ' CD1' HD12 ' A' ' 10' ' ' LEU . 4.4 p90 -135.45 13.95 3.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.864 -0.607 . . . . 75.41 111.369 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 17.0 mm-40 60.44 174.45 0.1 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.465 0.65 . . . . 72.21 111.584 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.534 ' HB2' ' OE1' ' A' ' 32' ' ' GLN . 9.1 tp -151.32 112.76 4.38 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.133 -0.485 . . . . 61.22 110.726 173.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.63 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 28.1 tt0 -124.77 118.76 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -99.94 120.52 49.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.865 -0.421 . . . . 73.23 109.865 -177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 71.2 mt -125.82 121.13 59.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.941 0.401 . . . . 73.12 111.178 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 9.3 m120 -66.62 125.7 26.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.742 -0.663 . . . . 72.54 111.162 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.44 HG22 HD13 ' A' ' 50' ' ' LEU . 22.3 pt -88.12 -23.24 6.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.459 -0.337 . . . . 74.0 110.268 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -59.92 117.18 4.73 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.383 0.611 . . . . 64.43 110.429 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.24 -31.02 6.95 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.482 -0.781 . . . . 31.34 111.465 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -92.79 113.34 25.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.233 -0.654 . . . . 73.02 109.233 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -38.13 89.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.696 -0.229 . . . . 64.1 111.553 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -60.6 -51.51 69.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.28 0.562 . . . . 74.04 110.4 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 44' ' ' ILE . 92.6 mt -67.58 -37.56 82.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.668 -0.697 . . . . 63.44 111.253 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.676 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 63.8 m -66.57 -43.46 84.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 75.54 110.842 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -67.28 -37.39 83.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.819 0.342 . . . . 75.4 110.293 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.2 -55.92 13.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.047 -0.524 . . . . 63.21 111.46 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.86 -66.07 0.97 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.394 -0.366 . . . . 71.5 111.529 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.676 ' HB2' ' O ' ' A' ' 51' ' ' THR . 58.7 t30 51.92 -83.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.111 0.782 . . . . 72.44 113.111 -175.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -85.44 -16.41 39.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.983 -0.553 . . . . 72.0 111.676 -170.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.62 78.0 1.48 Allowed 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.347 -1.353 . . . . 64.35 107.347 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.55 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.28 -97.54 0.0 OUTLIER Pre-proline 0 N--CA 1.423 -1.794 0 CA-C-O 118.163 -0.922 . . . . 70.23 110.676 -175.657 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.581 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 85.3 Cg_exo -21.29 75.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.821 2.347 . . . . 75.25 114.154 -149.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.956 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -107.23 122.89 62.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.267 -0.879 . . . . 71.51 110.798 -170.764 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 28' ' ' LEU . 48.1 mt -85.01 109.56 18.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.084 0.469 . . . . 72.42 110.769 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 88.1 t80 -92.46 124.11 36.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.448 -0.796 . . . . 74.31 110.691 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.83 109.17 16.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.744 . . . . 70.15 109.719 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.614 HG21 ' HD2' ' A' ' 9' ' ' LYS . 57.8 t -73.21 -20.53 18.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.289 -0.414 . . . . 43.41 111.794 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.49 -51.78 18.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.951 0.352 . . . . 64.42 111.951 -178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -100.95 -5.19 26.27 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.823 0.344 . . . . 72.21 111.464 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 63.61 78.87 0.27 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.495 0.664 . . . . 65.25 111.344 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.465 ' NZ ' ' HB2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -176.98 177.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.111 -0.95 . . . . 73.12 108.82 175.175 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.52 156.38 17.32 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 120.905 0.383 . . . . 72.32 110.694 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.414 ' HB3' HG12 ' A' ' 79' ' ' VAL . 66.1 mt -111.1 -76.32 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.621 0.724 . . . . 74.04 110.403 177.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 41.5 t -115.7 142.92 46.1 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.574 -1.194 . . . . 64.34 109.737 -175.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 17.7 p-80 -133.13 130.05 38.72 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.302 -0.408 . . . . 73.44 110.481 177.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.404 ' CZ ' ' HD2' ' A' ' 59' ' ' PRO . 71.4 m-85 68.7 140.02 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.099 -0.955 . . . . 74.42 112.348 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.568 ' H ' HD11 ' A' ' 20' ' ' LEU . 98.8 m-85 58.1 -105.77 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.205 -1.361 . . . . 63.34 111.352 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 12.0 tp 172.36 107.46 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 123.764 0.665 . . . . 74.04 109.537 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -71.73 -25.68 62.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 74.3 109.966 176.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.0 m 69.08 -55.03 0.56 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.116 -0.947 . . . . 65.14 112.189 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.12 -43.7 91.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.689 0.28 . . . . 71.11 111.733 -177.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 70' ' ' LEU . 84.1 t -64.12 -46.28 94.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.476 -0.329 . . . . 64.43 111.74 -177.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 10' ' ' LEU . 6.0 tp -70.51 -33.86 55.2 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 119.989 -0.685 . . . . 41.4 109.79 176.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.63 99.69 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.797 -0.716 . . . . 54.3 111.587 176.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.95 -32.02 71.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 63.25 110.907 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.834 -0.621 . . . . 74.12 111.065 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.7 OUTLIER -92.04 13.56 18.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 70.01 111.926 -176.228 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.696 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 67.7 m . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 110.028 -0.36 . . . . 65.14 110.028 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.0 ttm . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 120.92 0.39 . . . . 73.14 110.82 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -64.87 151.67 44.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.273 -0.421 . . . . 72.33 111.136 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -119.1 142.36 47.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.838 -0.619 . . . . 65.41 109.404 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -154.67 163.93 39.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.416 -0.356 . . . . 71.22 110.667 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.1 m -119.93 -177.84 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.177 -0.465 . . . . 75.54 110.622 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.485 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 13.4 pt-20 -88.8 163.07 36.62 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.755 -0.657 . . . . 72.44 109.439 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.485 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 61.2 Cg_endo -70.44 162.92 40.67 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.118 1.879 . . . . 63.3 111.461 177.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -101.52 173.27 6.51 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.366 -0.379 . . . . 75.23 110.482 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.536 ' HG2' ' HB2' ' A' ' 38' ' ' GLU . 19.8 mtpt -135.05 126.6 28.78 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.975 -0.557 . . . . 74.41 109.946 174.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.405 HD11 HD11 ' A' ' 80' ' ' ILE . 37.0 mt -108.45 120.79 43.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.868 -0.605 . . . . 75.25 110.305 173.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 40' ' ' GLU . 79.6 t -102.11 126.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.726 -0.67 . . . . 73.43 109.573 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.558 HG22 HD23 ' A' ' 61' ' ' LEU . 59.2 t -96.55 105.98 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 109.193 -0.669 . . . . 64.33 109.193 175.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.581 ' O ' HG23 ' A' ' 60' ' ' VAL . 35.6 m-85 -82.95 105.15 13.71 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.26 -0.644 . . . . 74.21 109.26 174.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.57 -168.15 12.65 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.568 -0.825 . . . . 60.33 111.488 -177.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.876 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.1 ptm180 -169.76 -159.03 0.2 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.882 -0.784 . . . . 74.42 108.882 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.98 109.04 0.28 Allowed 'General case' 0 C--N 1.318 -0.793 0 O-C-N 124.185 0.928 . . . . 73.21 109.271 171.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -155.31 -170.69 21.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.299 -0.953 . . . . 45.0 112.8 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.02 -155.09 0.59 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.562 0.22 . . . . 73.42 110.424 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 13.2 p80 -52.92 -33.23 49.69 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.988 1.107 . . . . 71.54 113.988 -170.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 20' ' ' LEU . 16.8 mt -56.62 -34.75 67.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.602 0.637 . . . . 62.41 112.025 -176.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 37.0 t -63.62 -43.9 95.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.425 -178.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -85.24 -21.29 29.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.52 -0.309 . . . . 73.51 111.29 -177.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.7 mt-10 -66.19 -44.74 83.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.864 0.364 . . . . 72.14 110.121 175.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.555 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.9 mtp -62.77 -40.58 97.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.001 -0.545 . . . . 75.43 110.28 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.564 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.6 mt -58.35 -49.85 80.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 54.4 110.562 176.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.48 94.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.362 -0.381 . . . . 63.23 111.194 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -61.3 -43.38 98.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.032 -0.531 . . . . 73.52 110.579 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.624 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 83.1 mt -66.04 -30.8 71.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 75.01 111.2 -179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 14.3 mmm180 -63.16 -38.67 92.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.95 0.405 . . . . 72.44 110.411 177.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.9 t -73.4 -40.54 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 73.34 110.617 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 31' ' ' LEU . 6.8 mt -64.81 -31.79 73.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 74.1 111.142 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -58.23 -24.85 60.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.719 0.295 . . . . 52.32 111.701 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -70.22 -28.97 65.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 74.54 110.537 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -93.71 -44.8 7.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 70.51 110.462 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.4 m -143.17 117.86 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.673 -0.694 . . . . 71.04 110.142 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.9 t-105 -78.13 128.92 34.53 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.11 0.481 . . . . 62.11 110.834 -178.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.624 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 2.6 p90 -141.72 20.18 2.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 70.21 110.82 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.536 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 63.5 mm-40 59.28 -178.2 0.09 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.147 0.499 . . . . 72.51 110.849 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.555 HD21 HG23 ' A' ' 25' ' ' ILE . 4.5 tp -151.6 109.9 3.76 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.686 -0.405 . . . . 71.24 110.718 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.515 ' HB3' HG22 ' A' ' 11' ' ' VAL . 24.1 tt0 -124.15 117.65 25.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.842 -0.617 . . . . 75.11 109.426 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.57 124.07 68.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.134 -0.484 . . . . 75.15 109.866 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.0 mt -128.9 117.75 45.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.419 -0.355 . . . . 71.53 111.176 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -67.69 114.47 6.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.998 -0.546 . . . . 51.33 111.047 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.6 pt -83.38 -8.85 11.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.452 -0.34 . . . . 65.03 110.62 177.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 15' ' ' ARG . 5.6 p-10 -74.97 -17.13 60.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 74.14 110.581 178.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.31 -8.58 59.87 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.942 -0.646 . . . . 53.54 111.954 177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -125.71 101.08 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.966 -0.383 . . . . 65.34 109.966 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 1.6 mp0 -54.43 -33.87 60.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.898 -0.592 . . . . 64.13 112.017 -174.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -66.57 -37.53 85.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 72.52 110.263 -177.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 53' ' ' LEU . 74.8 mt -74.9 -24.41 58.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.373 -0.376 . . . . 54.33 110.284 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 4.8 m -64.99 -33.68 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.407 0.622 . . . . 63.15 109.62 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 mmt85 -77.37 -32.51 55.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.864 -0.607 . . . . 72.51 110.207 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 50' ' ' LEU . 82.7 mt -79.15 -24.38 43.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.531 -0.759 . . . . 70.34 111.627 -178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -136.44 -75.51 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.645 0.239 . . . . 72.41 111.645 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.641 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.3 t30 46.33 -86.71 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.887 0.875 . . . . 73.52 112.882 -171.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -91.29 49.68 1.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.639 0.733 . . . . 73.25 110.29 -173.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG22 ' A' ' 60' ' ' VAL . 5.7 ttm-85 -156.44 32.05 0.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.703 -1.221 . . . . 44.24 107.703 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.876 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -73.78 -141.93 0.0 OUTLIER Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.272 0.841 . . . . 43.35 113.272 -166.944 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.76 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 41.0 Cg_exo -2.53 73.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 122.305 2.003 . . . . 72.14 112.956 -136.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -93.42 116.13 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 114.766 -1.107 . . . . 60.23 111.044 -169.213 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.558 HD23 HG22 ' A' ' 12' ' ' VAL . 32.9 mt -82.65 103.02 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.092 0.472 . . . . 72.54 110.35 173.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 82.1 t80 -95.19 126.05 40.25 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.171 -0.922 . . . . 70.01 110.013 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.98 108.26 15.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.146 -0.479 . . . . 45.15 110.739 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.451 ' CG2' HG23 ' A' ' 11' ' ' VAL . 51.0 t -77.93 147.19 7.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.11 -0.495 . . . . 63.01 109.731 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 67.45 26.35 8.32 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.076 -0.713 . . . . 74.14 109.076 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.575 ' HG2' ' HE2' ' A' ' 68' ' ' LYS . 7.7 tp10 -149.27 -45.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.051 -0.977 . . . . 71.23 109.433 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.503 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 t70 73.28 37.63 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.972 -1.013 . . . . 75.54 111.591 172.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HE2' ' HG2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -149.47 167.04 27.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.137 -0.483 . . . . 74.43 110.045 176.277 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -94.24 157.97 15.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.025 0.44 . . . . 64.14 111.633 -172.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.443 ' CD1' HD13 ' A' ' 80' ' ' ILE . 54.2 mt -112.7 -62.81 1.53 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 62.45 110.033 173.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.3 t -153.8 153.6 32.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 70.13 110.098 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.534 ' CD2' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -128.43 149.35 50.6 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.962 -0.385 . . . . 74.42 109.962 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.411 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 68.0 m-85 74.85 -33.64 0.25 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.81 0.844 . . . . 71.1 113.037 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -141.48 -177.91 5.38 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.016 -0.735 . . . . 75.41 109.016 -174.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 tp -121.1 111.93 18.05 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.779 -0.368 . . . . 74.33 111.195 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -90.69 98.3 11.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.185 -0.672 . . . . 64.41 109.185 175.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.0 m -61.55 -32.09 72.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.09 -0.505 . . . . 72.02 111.635 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.4 -48.33 67.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.86 0.362 . . . . 55.52 110.774 -176.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -66.86 -48.82 78.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.235 -0.439 . . . . 70.14 111.993 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.533 HD11 HD23 ' A' ' 84' ' ' LEU . 8.6 tp -69.69 -30.72 45.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.432 -0.507 . . . . 71.22 110.189 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -30.48 77.69 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.805 -0.712 . . . . 70.11 111.61 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.7 -37.82 55.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.927 0.394 . . . . 74.32 110.697 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -78.69 -54.86 5.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.021 -0.536 . . . . 72.41 111.515 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.559 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -76.3 -38.4 56.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.126 -0.488 . . . . 43.35 110.851 -175.741 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 115.557 -0.747 . . . . 72.3 111.243 -176.694 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.418 0.152 . . . . 64.54 111.267 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -56.59 -51.81 67.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.797 0.332 . . . . 65.44 110.891 -177.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -110.68 99.57 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.223 -0.444 . . . . 64.25 110.764 -179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.81 84.18 6.39 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.019 -0.734 . . . . 73.33 109.019 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.6 m -85.2 132.79 30.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.568 -0.742 . . . . 53.13 111.264 -176.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.48 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 41.4 mt-10 -133.15 158.07 76.71 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.098 -0.956 . . . . 73.41 109.504 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.48 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 68.4 Cg_endo -68.79 132.12 24.2 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.52 2.147 . . . . 60.35 113.025 -172.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.976 ' NH1' ' O ' ' A' ' 85' ' ' SER . 8.7 ptp180 -88.31 130.34 35.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.589 -0.893 . . . . 75.23 108.589 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.62 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.5 tttt -96.09 155.98 16.53 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.134 0.42 . . . . 71.34 112.134 -166.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.614 HD11 HD11 ' A' ' 80' ' ' ILE . 89.7 mt -125.85 148.3 49.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.908 -0.587 . . . . 71.4 110.215 173.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.609 HG23 HG21 ' A' ' 64' ' ' VAL . 55.1 t -127.03 135.51 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 116.239 -0.437 . . . . 71.3 109.958 175.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.724 HG22 HD23 ' A' ' 61' ' ' LEU . 86.8 t -108.85 119.62 58.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.344 -0.389 . . . . 50.34 110.155 176.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -95.9 115.84 28.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.843 -0.429 . . . . 63.51 109.843 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -139.07 -170.48 11.86 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.379 -0.915 . . . . 65.02 112.104 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB2' ' OD2' ' A' ' 45' ' ' ASP . 16.4 ptm180 -154.48 -177.35 6.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.827 -0.434 . . . . 74.12 109.827 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -78.32 155.6 30.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.146 -0.479 . . . . 72.52 110.825 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.33 31.87 45.03 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.937 -0.649 . . . . 52.03 112.138 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.1 m -143.09 94.08 2.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.803 0.335 . . . . 71.33 110.918 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -70.93 -28.75 64.73 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.24 0.543 . . . . 72.42 110.031 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.46 -34.45 64.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.09 -0.959 . . . . 44.34 110.279 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.9 t -68.13 -37.19 80.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 52.32 110.197 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.407 ' HA ' HD12 ' A' ' 25' ' ' ILE . 40.6 mt-10 -68.92 -33.14 73.26 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.217 0.532 . . . . 73.43 110.094 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.08 -36.7 84.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.657 -0.701 . . . . 73.13 110.409 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 85.2 mtp -63.99 -43.97 94.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.026 -0.533 . . . . 43.43 109.928 174.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.0 mt -55.05 -49.57 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.944 -0.571 . . . . 60.51 110.99 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.15 93.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.933 0.397 . . . . 72.01 110.919 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -62.98 -41.36 99.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.798 -0.637 . . . . 64.14 110.688 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.549 HD23 HD13 ' A' ' 39' ' ' LEU . 8.3 mp -66.45 -33.25 75.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.774 -0.648 . . . . 62.14 111.396 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.36 -42.19 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.893 0.378 . . . . 71.41 110.372 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.533 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 62.8 t -66.38 -44.37 90.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 64.22 110.71 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.41 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 11.8 mt -63.72 -33.61 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.53 -0.305 . . . . 73.45 111.505 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.478 ' OE1' ' HB2' ' A' ' 39' ' ' LEU . 10.8 mt-30 -58.4 -22.41 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.872 0.367 . . . . 72.25 111.898 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 49.6 mtmt -81.91 -11.45 58.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.165 0.507 . . . . 62.4 110.769 -178.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -110.56 -44.23 3.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.622 -0.717 . . . . 71.24 109.961 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.467 ' HB3' HD12 ' A' ' 84' ' ' LEU . 73.0 m -137.92 115.2 11.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.998 -1.001 . . . . 63.25 109.535 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -80.86 125.16 29.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.065 0.46 . . . . 71.02 110.806 -178.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.859 ' HB3' HD11 ' A' ' 84' ' ' LEU . 5.6 p90 -134.37 17.74 3.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.582 -0.736 . . . . 72.25 110.869 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.62 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 12.9 mm-40 59.98 -179.41 0.09 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.33 0.586 . . . . 75.52 110.304 -175.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.549 HD13 HD23 ' A' ' 28' ' ' LEU . 5.2 tp -152.54 112.55 4.0 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.538 -0.465 . . . . 75.52 111.291 172.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.516 ' HB3' HG22 ' A' ' 11' ' ' VAL . 22.7 tt0 -120.01 117.8 28.98 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.412 -0.588 . . . . 72.34 109.412 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.5 t -105.61 108.23 24.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.945 -0.571 . . . . 75.31 109.694 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.4 mt -108.5 113.02 42.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.852 -0.613 . . . . 71.52 110.526 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.453 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.7 m120 -81.1 124.77 29.49 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.644 . . . . 65.44 110.17 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.675 HG22 ' HB3' ' A' ' 50' ' ' LEU . 43.0 pt -69.97 -30.12 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.334 -0.394 . . . . 74.33 110.106 177.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -63.7 94.29 0.09 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.208 0.527 . . . . 63.25 109.874 170.519 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.02 -27.94 2.27 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.55 -1.02 . . . . 70.21 110.55 -174.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -120.65 109.29 15.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.938 -0.393 . . . . 65.51 109.938 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -58.5 -42.75 88.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.048 -0.524 . . . . 75.35 110.712 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -58.48 -41.26 84.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.411 . . . . 74.1 111.25 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.675 ' HB3' HG22 ' A' ' 44' ' ' ILE . 80.9 mt -76.31 -30.33 57.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.585 -0.279 . . . . 63.41 110.901 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.4 m -61.96 -45.35 94.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.085 0.469 . . . . 74.2 110.081 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -63.99 -30.91 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.063 -0.517 . . . . 71.23 110.926 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.07 -44.28 12.41 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.084 0.772 . . . . 75.11 113.084 -174.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.518 ' HB2' HG21 ' A' ' 44' ' ' ILE . 92.7 m-85 -117.03 -2.92 11.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.817 1.043 . . . . 73.53 113.817 -167.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -77.76 82.85 4.13 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 119.485 -0.886 . . . . 71.44 111.219 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.0 t70 171.63 -48.29 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 114.557 -1.201 . . . . 72.1 108.484 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 60' ' ' VAL . 18.0 ptt180 -109.1 54.11 0.67 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.419 -1.264 . . . . 71.13 109.613 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.811 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -144.97 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 112.228 0.455 . . . . 50.44 112.228 -171.402 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.811 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 67.8 Cg_exo -4.89 77.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.642 0 C-N-CA 122.599 2.199 . . . . 64.45 113.72 -138.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -92.12 128.05 43.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.087 -0.96 . . . . 74.22 110.469 -171.641 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.724 HD23 HG22 ' A' ' 12' ' ' VAL . 2.1 tm? -102.03 108.11 19.44 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.381 -0.599 . . . . 75.21 109.381 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -99.86 141.91 32.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.347 -0.842 . . . . 73.52 111.258 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.598 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -92.38 111.5 23.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.594 . . . . 73.22 111.0 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.609 HG21 HG23 ' A' ' 11' ' ' VAL . 21.6 t -99.42 88.37 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.587 0.708 . . . . 44.32 110.819 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 64.2 t30 175.29 -44.34 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.045 -1.835 . . . . 73.31 106.045 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 54.1 tt0 -125.53 104.83 8.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.71 -1.586 . . . . 60.2 107.474 163.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -52.12 90.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 124.264 0.977 . . . . 54.24 111.741 -175.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 25.6 pttm -160.85 156.62 25.34 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.842 -1.072 . . . . 64.31 110.105 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -89.84 141.04 29.01 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.637 -0.505 . . . . 74.15 109.637 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.3 mt -94.21 -55.67 3.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.45 110.166 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.2 t -158.63 175.13 14.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.03 -0.532 . . . . 52.1 109.852 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 7.7 p80 -144.2 136.77 26.84 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.802 -0.444 . . . . 52.02 109.802 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 96.0 m-85 73.99 139.56 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.518 1.136 . . . . 63.13 111.268 -174.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 61.15 -141.84 0.5 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.063 -0.971 . . . . 73.51 110.132 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 75' ' ' LEU . 14.0 tp -153.83 113.93 3.91 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.463 -0.495 . . . . 72.4 110.419 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.417 ' OD2' ' HB ' ' A' ' 79' ' ' VAL . 4.4 p-10 -58.66 -38.99 79.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.653 -0.703 . . . . 74.2 109.965 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.68 -49.8 0.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.364 -0.834 . . . . 65.33 112.004 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -79.22 -40.06 31.65 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.618 0.229 . . . . 64.42 111.618 -176.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.417 ' HB ' ' OD2' ' A' ' 76' ' ' ASP . 54.1 t -69.53 -47.65 70.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.62 0.247 . . . . 74.25 110.535 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.614 HD11 HD11 ' A' ' 10' ' ' LEU . 10.2 tp -65.57 -31.07 52.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.845 -0.342 . . . . 54.13 110.095 174.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.66 -29.14 74.48 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 120.768 -0.73 . . . . 64.33 111.61 176.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.73 -39.58 26.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.265 0.555 . . . . 72.34 110.278 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.598 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 82.3 t80 -71.88 -32.07 67.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.576 -0.738 . . . . 75.42 111.493 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.859 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -92.22 8.12 39.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.118 -0.492 . . . . 71.53 111.323 -178.319 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.976 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 8.3 t . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.176 -0.675 . . . . 52.54 109.176 176.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.947 0.404 . . . . 61.24 110.284 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -167.64 157.91 10.76 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.333 -0.617 . . . . 73.24 109.333 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -103.01 144.35 31.39 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.219 -0.289 . . . . 75.12 110.219 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -106.88 174.85 5.71 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.524 -0.547 . . . . 71.5 109.524 176.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.22 178.4 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.777 0.799 . . . . 54.43 111.893 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.592 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.9 pt-20 -133.16 166.9 25.87 Favored Pre-proline 0 C--N 1.312 -1.04 0 CA-C-N 114.461 -1.245 . . . . 72.12 108.659 -177.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.592 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.3 Cg_endo -73.46 130.06 14.53 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.855 1.703 . . . . 72.0 111.892 -176.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -96.27 -172.45 2.54 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.931 -0.766 . . . . 71.32 108.931 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 38' ' ' GLU . 26.3 mtpt -139.77 120.09 13.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.235 0.54 . . . . 65.51 111.138 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 80' ' ' ILE . 29.7 mt -107.34 123.64 48.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.349 -0.841 . . . . 72.22 110.59 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.627 HG22 ' HB3' ' A' ' 40' ' ' GLU . 47.8 t -102.28 127.17 56.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.874 -0.603 . . . . 73.13 109.51 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 ' CD2' ' A' ' 61' ' ' LEU . 40.7 t -104.02 108.8 25.47 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.091 -0.504 . . . . 54.42 109.913 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.902 ' HB2' HG12 ' A' ' 60' ' ' VAL . 45.5 m-85 -79.58 112.57 16.97 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.986 -0.746 . . . . 73.43 108.986 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.74 179.67 16.58 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.639 -0.791 . . . . 32.23 112.218 -177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.524 ' HG2' ' HB2' ' A' ' 45' ' ' ASP . 0.3 OUTLIER -151.56 118.57 5.86 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.34 -0.615 . . . . 74.03 109.34 -176.827 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.69 107.16 0.56 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.933 -0.576 . . . . 61.52 110.883 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.11 -20.01 4.06 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.584 -0.735 . . . . 64.14 111.366 -175.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 15' ' ' ARG . 60.5 m -87.56 118.94 27.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.869 0.366 . . . . 64.25 110.264 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.6 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 33.4 t60 -71.41 -33.56 69.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.51 . . . . 72.34 111.328 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -65.25 -31.01 71.94 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.778 -0.369 . . . . 74.21 110.842 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.406 ' O ' HG13 ' A' ' 25' ' ' ILE . 42.9 t -54.97 -47.31 74.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.989 -178.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 13.9 pt-20 -71.16 -32.22 68.65 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.364 -0.38 . . . . 73.25 110.945 -178.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.0 mt-10 -71.61 -34.9 70.24 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.074 -0.512 . . . . 72.32 110.522 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.79 ' HG3' ' HB3' ' A' ' 59' ' ' PRO . 87.1 mmm -63.83 -43.04 97.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.902 -0.59 . . . . 74.23 110.123 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.623 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 77.1 mt -54.4 -50.58 56.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 74.4 110.78 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.84 -39.74 86.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.343 -0.39 . . . . 65.34 110.973 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -61.64 -44.0 97.8 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.949 -0.569 . . . . 75.23 110.704 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -66.11 -38.46 88.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.96 -0.564 . . . . 51.54 111.299 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.1 mmm180 -58.2 -41.83 84.86 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.676 0.274 . . . . 72.51 111.574 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.558 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 60.0 t -68.89 -40.49 81.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.856 0.36 . . . . 71.11 111.056 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -33.55 70.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.02 0.438 . . . . 63.43 109.92 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.59 -30.15 69.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.53 -0.759 . . . . 72.03 110.742 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 52.7 mtmt -69.28 -33.62 73.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 75.23 110.749 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -83.15 -46.06 13.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.619 -0.718 . . . . 73.5 110.281 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.453 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.9 m -135.22 118.24 16.38 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.661 -0.7 . . . . 74.3 109.511 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -76.99 117.81 18.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.476 0.655 . . . . 63.02 111.447 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -129.34 22.98 5.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.303 -0.862 . . . . 74.22 110.43 177.427 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 19.9 mm-40 57.4 -179.93 0.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.501 -175.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.401 ' HA ' HD12 ' A' ' 39' ' ' LEU . 11.3 tp -152.55 117.03 4.99 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.877 -0.729 . . . . 73.44 110.778 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 11' ' ' VAL . 14.9 tt0 -124.41 117.39 24.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.872 -0.788 . . . . 60.14 108.872 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 56.3 t -109.04 111.43 36.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.305 -0.407 . . . . 73.03 109.905 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.6 mt -117.86 109.93 29.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.062 -0.517 . . . . 73.21 110.741 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.69 124.82 27.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.978 177.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.562 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.7 pt -86.8 -14.55 10.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.56 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.524 ' HB2' ' HG2' ' A' ' 15' ' ' ARG . 13.6 t70 -56.51 -34.67 67.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.841 -0.618 . . . . 75.41 111.82 -174.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.9 27.41 10.09 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.704 -0.76 . . . . 73.25 113.02 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 22.6 t-20 -152.76 115.66 4.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.645 -0.327 . . . . 73.44 110.512 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.69 -34.92 67.9 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.797 0.295 . . . . 73.05 111.797 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 36.5 m80 -69.34 -53.86 17.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.801 -0.444 . . . . 64.32 109.801 -177.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 mt -65.79 -39.45 90.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.757 -0.656 . . . . 74.5 111.381 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 95.2 m -54.24 -57.72 10.11 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 120.612 0.244 . . . . 64.33 110.753 178.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 -67.54 -31.02 70.83 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 121.069 -0.252 . . . . 75.24 111.264 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 49' ' ' HIS . 0.5 OUTLIER -67.19 -52.39 41.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.54 -0.3 . . . . 74.41 111.52 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.555 ' HB2' HD13 ' A' ' 44' ' ' ILE . 70.3 m-85 -111.47 19.74 17.9 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 112.352 0.501 . . . . 73.31 112.352 -173.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HB2' ' O ' ' A' ' 51' ' ' THR . 8.8 t30 -59.83 -37.74 80.08 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.224 0.466 . . . . 62.24 110.568 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -103.07 14.11 32.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.7 0.762 . . . . 70.41 109.741 176.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.494 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 14.2 ttm180 -138.44 29.14 2.44 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.897 -0.592 . . . . 60.11 109.648 -176.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.861 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -84.5 -146.42 0.0 OUTLIER Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 118.525 -0.75 . . . . 64.3 109.729 176.85 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.861 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 35.1 Cg_exo -2.43 70.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.991 0 C-N-CA 122.351 2.034 . . . . 63.21 112.694 -139.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.902 HG12 ' HB2' ' A' ' 13' ' ' TYR . 4.0 p -116.91 139.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-N 114.553 -1.203 . . . . 74.5 110.396 -165.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.559 ' CD2' HG22 ' A' ' 12' ' ' VAL . 58.6 mt -103.13 110.6 22.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.985 0.421 . . . . 75.05 110.923 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.1 t80 -92.18 120.48 32.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.623 -0.717 . . . . 72.43 109.909 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.97 100.65 9.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.63 . . . . 71.54 110.981 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.54 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.7 t -79.02 98.83 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.336 -0.393 . . . . 54.11 110.291 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 18.1 t-20 168.46 -39.53 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.273 -0.876 . . . . 74.1 108.691 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -125.34 1.87 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.521 -0.763 . . . . 63.12 110.672 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.89 81.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.662 -0.699 . . . . 75.42 111.952 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -173.03 149.6 1.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 73.53 110.043 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 62' ' ' PHE . 1.9 mp0 -88.07 144.93 26.23 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.851 -0.426 . . . . 74.33 109.851 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.4 mt -88.36 -51.33 5.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.014 0.435 . . . . 74.31 110.671 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.7 t -150.79 158.84 44.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 70.24 109.898 -177.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.706 ' HB3' HG23 ' A' ' 60' ' ' VAL . 2.2 p80 -136.17 129.43 31.69 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.661 -0.496 . . . . 64.34 109.661 177.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 73.4 m-85 65.47 121.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 124.18 0.925 . . . . 72.51 110.472 -173.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 72.1 m-85 69.5 171.75 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.193 -0.912 . . . . 61.43 110.767 -175.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.1 tp -123.24 118.3 27.28 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.751 -0.379 . . . . 72.4 111.83 -169.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -92.64 106.24 18.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.915 -0.584 . . . . 53.13 110.026 173.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.1 m -68.52 -39.42 81.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.012 -0.54 . . . . 45.31 111.534 -176.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.46 -41.11 85.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.945 0.402 . . . . 63.55 111.046 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.4 t -66.52 -41.47 88.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 41.22 111.536 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.598 HD11 HD11 ' A' ' 10' ' ' LEU . 8.4 tp -72.55 -31.67 38.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.188 -0.605 . . . . 63.42 110.022 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.58 78.06 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.748 -0.739 . . . . 64.55 111.554 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.14 -29.83 66.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.757 0.313 . . . . 73.33 111.042 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -87.12 -42.26 13.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 74.11 111.556 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.485 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -69.02 -21.18 64.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.065 -0.516 . . . . 74.34 111.95 -174.474 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.326 -0.452 0 N-CA-C 109.628 -0.508 . . . . 44.13 109.628 176.501 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttp . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.769 0.318 . . . . 74.02 110.296 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -68.08 115.15 7.24 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.846 -0.798 . . . . 64.33 108.846 174.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -79.05 124.99 28.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.505 0.669 . . . . 71.44 111.072 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -112.4 83.61 1.83 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.664 -0.698 . . . . 74.24 109.582 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -91.8 137.66 21.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.699 -0.682 . . . . 71.01 110.003 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -129.06 153.02 80.27 Favored Pre-proline 0 C--N 1.308 -1.214 0 CA-C-N 115.131 -0.941 . . . . 63.2 109.833 -176.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -75.51 177.94 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.341 2.027 . . . . 64.34 111.729 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 9.4 mpt_? -91.93 -179.1 5.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.322 -0.622 . . . . 72.12 109.322 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.755 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.3 tmtp? -142.64 115.17 8.53 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.041 0.448 . . . . 70.03 109.918 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 HD11 ' A' ' 80' ' ' ILE . 79.7 mt -105.66 133.37 50.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.941 -0.572 . . . . 73.2 111.131 178.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.6 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 68.2 t -107.34 127.3 63.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.602 -0.726 . . . . 63.02 109.61 172.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 61' ' ' LEU . 92.4 t -96.64 112.13 28.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 120.953 0.406 . . . . 71.44 110.206 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 1.012 ' HB2' HG23 ' A' ' 60' ' ' VAL . 61.1 m-85 -81.91 111.86 18.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.161 -0.472 . . . . 75.54 109.879 175.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' O ' HG12 ' A' ' 44' ' ' ILE . . . -120.92 -161.72 11.49 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 110.361 -1.096 . . . . 75.42 110.361 176.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.75 ' HG2' HG11 ' A' ' 58' ' ' VAL . 2.1 ptp180 -164.48 -53.52 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.692 0.746 . . . . 63.34 112.28 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -137.08 -175.19 3.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.606 -0.27 . . . . 71.42 111.068 -169.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -79.0 62.61 3.96 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 116.073 -0.512 . . . . 60.02 113.322 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 m -81.84 134.55 35.43 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.212 -0.662 . . . . 71.12 109.212 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.499 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.0 t60 -68.48 -38.66 81.23 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.504 -0.478 . . . . 55.52 109.836 -176.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 20' ' ' LEU . 23.3 mt -57.37 -31.62 65.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.439 -0.346 . . . . 62.2 111.499 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.443 ' O ' HG13 ' A' ' 25' ' ' ILE . 41.9 t -57.62 -49.5 76.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.452 -0.34 . . . . 75.12 110.426 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.4 pt-20 -70.63 -29.2 65.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.783 0.325 . . . . 71.12 110.436 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 38.2 mt-10 -70.1 -39.73 75.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.985 0.421 . . . . 73.34 110.151 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 89.9 mmm -64.62 -45.49 86.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.048 -0.524 . . . . 72.24 110.004 174.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.2 mt -55.41 -49.64 71.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.261 -0.427 . . . . 71.55 110.285 177.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -60.03 -42.81 95.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.706 0.289 . . . . 75.32 110.9 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.2 m -55.79 -49.08 74.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.235 -0.439 . . . . 64.31 110.757 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.467 HD21 HD11 ' A' ' 61' ' ' LEU . 4.2 mm? -67.25 -38.86 85.86 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.155 -0.475 . . . . 73.11 111.155 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 22.8 mmm180 -61.07 -38.75 87.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 64.12 110.987 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.574 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 93.9 t -68.53 -44.28 83.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.258 -0.428 . . . . 63.52 111.101 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.48 -32.22 73.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.153 0.502 . . . . 63.41 109.732 178.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.459 ' HA ' ' O ' ' A' ' 35' ' ' SER . 35.5 tt0 -64.13 -21.64 66.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.598 -0.728 . . . . 71.32 110.404 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 57.7 mtmt -78.45 -11.84 59.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.585 -0.734 . . . . 71.31 110.943 177.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.18 -48.48 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.168 0.508 . . . . 73.13 109.716 173.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.473 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.7 m -133.81 127.99 33.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.405 -0.816 . . . . 73.25 110.209 -177.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -82.22 131.3 35.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.217 0.532 . . . . 74.13 111.354 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.534 ' HB3' HD21 ' A' ' 84' ' ' LEU . 7.5 p90 -140.21 22.01 2.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.419 -0.81 . . . . 75.25 110.697 177.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 58.2 -176.08 0.08 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.135 -0.484 . . . . 64.21 110.402 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.28 137.03 19.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.759 -0.46 . . . . 62.1 109.759 175.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.723 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 4.2 tp10 -136.71 143.42 43.34 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.139 -0.689 . . . . 73.33 109.139 174.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -127.9 109.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.999 -0.371 . . . . 73.21 109.999 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.519 HD12 HG11 ' A' ' 11' ' ' VAL . 75.9 mt -123.99 109.85 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.309 -0.405 . . . . 54.41 110.881 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -81.53 111.42 17.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.219 -0.446 . . . . 62.55 110.129 176.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.558 HD13 ' HB2' ' A' ' 54' ' ' TYR . 48.4 pt -76.97 -2.01 4.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 71.31 111.153 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 35.3 t70 -61.96 -32.66 73.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.099 -0.501 . . . . 45.22 110.766 -178.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -95.53 0.58 63.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.918 -0.658 . . . . 61.21 112.116 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.68 97.82 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.716 -0.476 . . . . 74.54 109.716 -179.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -58.79 -43.04 90.38 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.735 -0.666 . . . . 54.34 111.276 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -76.08 -30.51 58.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.677 0.275 . . . . 60.45 110.851 -172.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.17 -26.69 53.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.818 0.342 . . . . 70.03 110.71 176.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.503 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 50.5 m -59.89 -37.68 80.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.635 176.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -56.41 -32.56 64.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.165 0.507 . . . . 73.15 110.706 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.15 -57.5 2.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.774 -0.648 . . . . 74.22 111.572 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.6 m-85 -104.51 13.66 31.37 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.116 0.784 . . . . 73.03 113.116 -166.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 51' ' ' THR . 12.6 t30 -52.59 -58.22 7.49 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.341 0.519 . . . . 55.53 111.852 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -90.7 -3.18 57.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.023 0.439 . . . . 64.43 111.3 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.25 74.52 1.24 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.969 -0.752 . . . . 71.43 108.969 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.857 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -100.52 -141.17 0.0 OUTLIER Pre-proline 0 N--CA 1.439 -1.01 0 CA-C-O 118.37 -0.824 . . . . 74.13 109.835 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.857 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 77.2 Cg_exo -9.03 71.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.806 0 C-N-CA 122.778 2.318 . . . . 72.34 114.351 -140.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 1.012 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -103.89 136.26 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.423 -0.808 . . . . 75.34 111.583 -173.373 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.6 HD23 HG22 ' A' ' 12' ' ' VAL . 96.1 mt -93.32 109.22 20.77 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.488 -0.778 . . . . 63.31 110.216 177.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.6 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.0 t80 -92.08 125.5 36.79 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.362 -0.835 . . . . 74.31 109.937 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -82.64 104.94 13.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 72.24 110.566 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 85.5 t -70.9 154.29 8.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.567 -0.531 . . . . 74.01 109.567 177.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 87.0 m-20 78.98 -38.03 0.2 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.714 0.806 . . . . 62.23 110.145 -174.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.588 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 51.8 mm-40 -87.13 -33.61 19.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.859 -0.61 . . . . 72.43 111.031 175.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 61.7 66.34 0.85 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.561 0.696 . . . . 65.35 109.905 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.588 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 3.2 ptpp? -160.23 153.51 21.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.294 -0.866 . . . . 75.45 109.992 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 mp0 -87.66 144.19 26.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.34 -0.615 . . . . 71.2 109.34 174.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.2 mt -109.99 -56.51 2.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.023 0.44 . . . . 74.14 111.291 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 46.6 t -140.76 157.49 45.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.897 -0.592 . . . . 72.52 110.472 -169.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 18.3 p-80 -127.63 -171.96 2.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.344 -0.613 . . . . 74.34 109.344 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 13.0 p90 -48.88 144.27 4.74 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.606 0.241 . . . . 71.02 111.548 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 36.3 m-85 71.1 90.15 0.1 Allowed 'General case' 0 C--O 1.236 0.355 0 O-C-N 124.101 0.875 . . . . 65.22 108.827 -165.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.72 126.2 25.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.659 -1.155 . . . . 74.14 111.522 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -75.15 -35.96 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.763 -0.653 . . . . 75.13 110.238 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.37 -48.19 0.68 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.099 -0.955 . . . . 74.23 112.278 178.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.45 -50.6 58.49 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.819 0.303 . . . . 51.12 111.819 -175.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.6 -51.24 75.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 111.782 0.29 . . . . 54.33 111.782 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.793 HD11 HD23 ' A' ' 84' ' ' LEU . 7.1 tp -68.47 -29.57 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 119.834 -0.746 . . . . 74.15 110.298 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.04 -41.35 97.26 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.684 -0.77 . . . . 73.03 111.582 176.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.37 -26.38 68.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.28 0.562 . . . . 62.22 110.633 176.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.428 ' CE2' ' HG2' ' A' ' 8' ' ' ARG . 85.1 t80 -88.0 -50.37 6.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.796 -0.638 . . . . 73.32 111.52 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.793 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -76.52 -39.18 53.74 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.335 0.495 . . . . 73.54 112.335 -172.123 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.7 p . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.778 -0.369 . . . . 74.52 111.345 -173.919 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttp . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.237 -0.283 . . . . 61.55 110.237 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -179.58 127.92 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.29 0.567 . . . . 60.35 111.286 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -129.59 78.17 1.83 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.31 -0.996 . . . . 71.44 108.31 169.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.4 88.91 6.98 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.588 0.709 . . . . 75.33 111.171 -172.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.6 m -104.29 129.85 55.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.036 -0.984 . . . . 73.24 109.126 172.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 35.8 mt-10 -132.18 156.45 80.09 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.217 -0.447 . . . . 74.15 110.665 -171.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 59.3 Cg_endo -69.4 173.62 10.39 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.754 2.303 . . . . 72.35 112.896 -175.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.529 ' HG3' ' HA ' ' A' ' 84' ' ' LEU . 0.5 OUTLIER -108.26 -170.23 1.64 Allowed 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.042 -0.725 . . . . 73.02 109.042 178.093 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 83.6 tttt -146.58 128.68 15.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.081 0.467 . . . . 74.32 110.57 171.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.602 HD11 HD11 ' A' ' 80' ' ' ILE . 80.6 mt -114.96 129.82 56.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 62.41 110.212 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -107.63 126.36 63.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.061 -0.518 . . . . 54.32 109.704 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.575 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 55.8 t -106.09 108.66 25.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.284 0.564 . . . . 63.13 110.058 176.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.674 ' HB2' HG23 ' A' ' 60' ' ' VAL . 96.1 m-85 -81.68 110.62 17.2 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 72.43 109.069 174.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -113.95 171.06 13.58 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.448 -0.882 . . . . 51.22 113.019 -173.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HB2' HG11 ' A' ' 58' ' ' VAL . 45.5 ttt180 -159.32 21.7 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.386 -0.968 . . . . 74.22 108.386 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 62.07 -97.64 0.07 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.248 -1.342 . . . . 60.24 110.191 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.47 -89.05 1.31 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.898 -0.668 . . . . 72.43 113.103 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.3 t -143.07 -167.69 2.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.77 0.319 . . . . 54.12 110.944 -173.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.488 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 22.5 m-70 -69.15 -30.52 68.78 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 113.047 0.758 . . . . 73.14 113.047 -169.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 73' ' ' TYR . 32.4 mt -53.47 -31.29 45.08 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 120.873 -0.331 . . . . 64.11 111.605 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.473 ' O ' HG13 ' A' ' 25' ' ' ILE . 27.1 t -60.14 -48.45 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.492 -0.322 . . . . 72.22 110.912 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.3 pt-20 -73.95 -32.86 63.67 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.754 0.311 . . . . 73.41 110.762 -178.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.09 -41.14 96.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.201 0.524 . . . . 75.34 110.06 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.619 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 89.4 mmm -65.27 -46.34 80.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.718 -0.674 . . . . 71.01 110.803 176.287 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.481 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.8 mt -56.55 -48.2 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.335 -0.393 . . . . 64.34 111.497 -178.164 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.17 92.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.068 0.461 . . . . 62.14 110.936 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.6 m -64.67 -39.11 93.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.866 -0.606 . . . . 61.13 111.272 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 24' ' ' MET . 83.3 mt -63.41 -38.72 92.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 74.15 110.95 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.3 mmm180 -62.87 -42.72 99.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.913 -177.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.448 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 68.1 t -71.28 -42.48 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.376 -0.375 . . . . 74.45 110.983 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -66.02 -31.87 73.02 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.048 -0.353 . . . . 71.31 110.048 -179.657 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.44 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -57.99 -28.94 64.86 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.965 0.412 . . . . 75.4 110.907 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 48.4 mtmt -79.86 -12.49 59.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 72.23 110.868 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -103.63 -41.73 5.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 73.43 109.748 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.418 ' HB3' HD12 ' A' ' 84' ' ' LEU . 43.5 m -148.52 119.13 7.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.089 -0.959 . . . . 71.13 109.13 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -72.28 129.58 38.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 64.24 111.239 -176.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 p90 -139.53 21.7 2.53 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.67 -0.695 . . . . 72.11 110.932 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.561 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 22.9 mm-40 59.15 -177.62 0.09 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.94 0.4 . . . . 65.11 110.309 -177.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.44 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 7.0 tp -154.3 109.96 3.18 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.485 -0.486 . . . . 64.32 110.476 168.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -114.75 117.87 31.98 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.425 -0.583 . . . . 73.34 109.425 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.7 t -110.84 110.3 31.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.902 -0.59 . . . . 75.12 110.249 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.1 mt -119.6 111.26 32.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.167 -0.47 . . . . 64.33 110.544 -176.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.2 m120 -81.16 113.95 19.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.25 -0.432 . . . . 61.33 110.175 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 51' ' ' THR . 33.8 pt -79.4 0.01 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.926 -0.579 . . . . 73.53 111.964 -173.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.2 -39.52 90.52 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.088 0.471 . . . . 73.34 111.062 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.03 8.73 68.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.777 -0.725 . . . . 65.1 112.753 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -137.71 97.48 3.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.735 0.268 . . . . 74.52 110.557 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 48' ' ' GLU . 3.9 mp0 -54.22 -33.94 59.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.282 -0.417 . . . . 63.14 110.456 178.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.3 m170 -57.19 -48.95 77.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.5 -0.773 . . . . 71.23 110.064 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' A' ' 53' ' ' LEU . 90.8 mt -77.84 -26.8 49.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.811 -0.632 . . . . 72.41 111.087 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.591 ' HA ' HD12 ' A' ' 44' ' ' ILE . 85.5 m -56.37 -48.97 75.76 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.296 -0.411 . . . . 42.32 111.24 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -66.39 -31.7 72.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.838 0.351 . . . . 75.53 110.836 -176.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 50' ' ' LEU . 71.0 mt -64.32 -48.49 75.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.888 -0.596 . . . . 61.12 111.314 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 44' ' ' ILE . 81.7 m-85 -119.08 24.84 10.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.43 -0.35 . . . . 72.41 111.905 -172.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 51' ' ' THR . 28.1 t-20 -62.36 120.72 11.57 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.023 -0.271 . . . . 73.15 110.43 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' ASN . 20.8 t70 71.66 -3.49 2.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.752 0.786 . . . . 62.4 110.614 -176.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -115.43 32.91 5.76 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.195 -0.669 . . . . 60.43 109.195 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.782 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -82.51 -140.85 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.662 0 CA-C-O 118.636 -0.697 . . . . 64.34 111.071 -176.424 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.782 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 28.1 Cg_exo -3.89 69.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.729 0 C-N-CA 122.536 2.157 . . . . 63.51 113.278 -139.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.674 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -92.08 131.41 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-N 114.641 -1.163 . . . . 73.44 110.837 -172.215 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 10' ' ' LEU . 2.3 tm? -97.65 101.99 13.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.591 -0.892 . . . . 64.32 108.591 174.111 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.2 t80 -95.29 124.55 39.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.866 -1.061 . . . . 72.53 110.435 -175.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 106.17 17.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.052 -0.522 . . . . 63.12 110.58 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.49 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 58.3 t -67.72 152.85 9.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.558 -0.534 . . . . 71.33 109.558 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 92.8 m-20 76.74 -39.01 0.33 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.528 0.731 . . . . 64.03 110.551 -176.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.86 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 21.2 mm-40 -76.73 -35.98 57.44 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.44 -0.578 . . . . 74.54 109.44 170.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 0.5 OUTLIER 61.51 41.7 12.24 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.89 -1.05 . . . . 74.13 109.479 179.509 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.86 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 1.2 ptpp? -142.15 164.5 30.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.036 -0.984 . . . . 73.1 110.471 -178.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -87.47 134.68 33.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.209 -0.451 . . . . 75.34 110.079 174.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.27 -49.99 6.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.255 -0.646 . . . . 71.25 109.255 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.9 t -168.15 165.97 13.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.984 -0.747 . . . . 52.51 108.984 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -144.17 143.99 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 121.202 -0.199 . . . . 63.54 110.661 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.472 ' HB3' HD13 ' A' ' 20' ' ' LEU . 64.3 m-85 74.15 -34.65 0.28 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 124.129 0.893 . . . . 72.23 111.785 -176.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -126.51 165.48 19.05 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.616 -0.513 . . . . 54.14 109.616 -176.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.7 tp -119.71 103.37 9.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.987 0.422 . . . . 72.41 111.017 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.29 96.63 10.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.812 -0.631 . . . . 64.21 109.567 174.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.514 ' HA ' HG22 ' A' ' 80' ' ' ILE . 8.6 m -61.56 -30.1 70.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.674 -0.693 . . . . 72.21 111.472 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -64.18 -42.53 96.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 74.12 110.558 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 71.0 t -75.52 -44.37 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 71.21 111.359 -177.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.602 HD11 HD11 ' A' ' 10' ' ' LEU . 8.0 tp -66.44 -34.32 69.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.358 -0.537 . . . . 72.23 110.269 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.08 91.49 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.882 -0.675 . . . . 74.04 111.779 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.77 -33.38 75.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 64.14 111.038 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -87.35 -40.19 14.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.971 -0.559 . . . . 74.23 111.88 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.604 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -76.8 2.41 14.52 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.699 0.629 . . . . 71.24 112.699 -171.712 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--N 1.319 -0.729 0 N-CA-C 110.224 -0.288 . . . . 63.32 110.224 176.342 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.448 0.642 . . . . 73.35 110.066 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -146.13 13.82 1.28 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.182 -0.463 . . . . 53.31 110.619 -173.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.12 100.34 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.769 0.668 . . . . 70.35 110.551 -174.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -84.92 96.24 9.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 65.21 110.229 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.5 m -86.07 131.31 34.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.908 -0.587 . . . . 61.12 110.64 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.589 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 12.0 pt-20 -60.5 162.35 11.56 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 114.859 -1.064 . . . . 55.01 111.126 -178.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 58.9 Cg_endo -71.98 144.74 43.51 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.306 2.004 . . . . 73.1 112.312 -177.139 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.569 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -111.9 138.79 48.04 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.82 -0.807 . . . . 72.5 108.82 175.864 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.586 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 77.9 tttt -88.05 149.79 23.77 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.281 0.562 . . . . 54.51 112.501 -167.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 80' ' ' ILE . 75.2 mt -115.45 131.78 56.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.274 -0.876 . . . . 75.55 110.717 174.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.591 HG23 ' CG2' ' A' ' 64' ' ' VAL . 52.5 t -104.33 133.81 47.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 75.22 109.42 172.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.481 HG22 HD23 ' A' ' 61' ' ' LEU . 21.8 t -98.86 105.7 17.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 C-N-CA 120.165 -0.614 . . . . 75.54 109.426 172.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.75 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 23.6 m-85 -72.13 154.42 41.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 109.189 -0.671 . . . . 73.12 109.189 174.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.581 ' HA2' HG12 ' A' ' 58' ' ' VAL . . . 156.01 -145.27 11.98 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.248 -0.977 . . . . 64.15 111.963 175.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.619 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 8.9 ptm180 -161.03 177.27 10.5 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.447 -0.575 . . . . 73.42 109.447 176.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -77.88 111.48 13.75 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.113 0.482 . . . . 75.23 111.656 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.71 63.43 0.2 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.852 -0.613 . . . . 64.12 112.669 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -148.38 115.34 6.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 71.33 110.814 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.455 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 57.1 t60 -70.91 -39.14 72.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.359 -0.382 . . . . 60.11 111.388 -176.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.441 HD23 ' OE2' ' A' ' 23' ' ' GLU . 15.8 mt -59.72 -31.18 69.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.877 0.37 . . . . 62.22 110.986 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.586 ' O ' HG13 ' A' ' 25' ' ' ILE . 35.3 t -61.04 -45.89 92.93 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.591 -0.522 . . . . 60.03 109.591 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.416 ' O ' ' HB ' ' A' ' 25' ' ' ILE . 30.2 mt-10 -60.73 -47.75 84.9 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.853 -0.612 . . . . 53.22 110.733 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 31.9 mt-10 -63.22 -38.3 90.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.419 -0.809 . . . . 73.1 111.619 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.566 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 45.5 mtp -72.13 -27.94 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.667 -0.413 . . . . 74.4 110.852 177.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 21' ' ' CYS . 67.6 mt -59.12 -45.91 92.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.986 -0.375 . . . . 70.45 109.986 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.97 -41.73 96.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.088 -0.505 . . . . 64.31 110.746 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 m -65.18 -42.38 93.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.009 -0.541 . . . . 73.33 110.719 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 24' ' ' MET . 79.0 mt -67.27 -31.95 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 74.04 111.101 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm-85 -62.11 -44.02 97.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.07 0.462 . . . . 71.54 110.156 175.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.57 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 57.9 t -62.97 -41.46 92.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 53.44 110.492 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -68.1 -33.86 75.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.359 -0.382 . . . . 71.23 110.284 179.349 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.472 ' HA ' ' O ' ' A' ' 35' ' ' SER . 39.8 mt-30 -61.23 -20.86 63.3 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.754 0.312 . . . . 61.31 111.484 177.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.8 mtmt -78.74 -17.72 55.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.168 0.509 . . . . 71.42 110.687 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -99.09 -45.98 5.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 74.14 109.563 176.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 25.5 m -144.88 122.83 12.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.367 -0.833 . . . . 71.11 109.559 -178.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -78.68 135.33 37.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.642 0.258 . . . . 72.53 110.651 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 8.2 p90 -146.01 14.23 1.32 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.487 -0.324 . . . . 74.11 111.561 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.559 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 16.7 mt-10 54.9 -174.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.626 0.726 . . . . 53.52 111.203 -175.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 39' ' ' LEU . 6.0 tp -150.85 109.8 3.89 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.83 -0.623 . . . . 73.45 110.351 174.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.586 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 6.2 tp10 -108.7 147.17 32.33 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 75.24 110.225 -178.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -123.65 125.62 71.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.605 -0.517 . . . . 73.45 109.605 176.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 HG11 ' A' ' 11' ' ' VAL . 77.7 mt -135.43 119.87 26.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.919 0.39 . . . . 61.52 110.804 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.619 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 42.6 m-80 -80.66 129.61 34.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 61.14 111.311 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.0 pt -88.56 -15.48 9.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.948 -0.569 . . . . 71.14 110.323 175.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -48.48 -45.67 37.16 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.283 -0.872 . . . . 74.14 112.472 -172.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -87.78 -0.58 83.66 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.654 -0.784 . . . . 64.32 113.276 -176.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 50' ' ' LEU . 51.8 m-80 -110.42 111.82 23.34 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.165 -0.309 . . . . 72.32 110.165 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.28 -47.29 78.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.995 -0.548 . . . . 72.2 111.721 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -70.75 -37.9 73.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.69 0.281 . . . . 74.3 110.475 -174.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 47' ' ' ASN . 69.3 mt -69.22 -33.07 72.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 54.43 110.54 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.475 ' HA ' HD12 ' A' ' 44' ' ' ILE . 94.3 m -57.69 -56.76 17.72 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.188 -0.46 . . . . 51.25 110.475 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.822 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.54 -29.9 68.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.753 0.279 . . . . 75.15 111.753 -178.437 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.6 mt -75.76 -48.13 23.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.466 0.543 . . . . 71.32 112.466 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.534 ' HB2' HD13 ' A' ' 44' ' ' ILE . 51.0 m-85 -122.83 7.87 9.37 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 113.621 0.971 . . . . 70.34 113.621 -167.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.8 t-20 -59.86 -50.42 73.86 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 118.746 0.703 . . . . 74.24 111.766 -176.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -77.12 -20.58 55.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.907 -0.588 . . . . 62.54 111.169 -175.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -128.63 75.15 1.61 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.303 -0.628 . . . . 70.43 109.303 175.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.869 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.19 -142.92 0.0 OUTLIER Pre-proline 0 N--CA 1.438 -1.061 0 CA-C-O 117.823 -1.084 . . . . 64.51 109.335 176.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.869 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 94.7 Cg_exo -10.96 101.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.954 0 C-N-CA 122.32 2.013 . . . . 74.31 113.787 -141.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.621 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -129.43 142.82 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 123.427 0.455 . . . . 52.12 110.98 -176.317 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 1.047 ' HG ' ' HD2' ' A' ' 72' ' ' HIS . 22.7 mt -88.11 123.3 32.63 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.094 0.473 . . . . 75.03 111.539 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.509 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 89.7 t80 -105.28 129.9 53.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.083 -0.962 . . . . 74.51 110.296 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.423 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -80.43 104.07 10.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.165 -0.47 . . . . 53.03 110.926 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.591 ' CG2' HG23 ' A' ' 11' ' ' VAL . 46.9 t -80.79 81.78 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.964 0.412 . . . . 75.21 110.668 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 30.5 t-20 172.92 -59.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.124 -0.944 . . . . 64.22 108.963 177.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.05 -7.9 52.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.554 -0.748 . . . . 73.1 110.35 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.4 t70 60.58 78.79 0.27 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.522 0.677 . . . . 74.44 111.395 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -171.42 148.42 2.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.486 -0.779 . . . . 74.11 110.932 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.2 137.69 38.28 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.748 -0.464 . . . . 52.34 109.748 174.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 mt -98.97 -82.41 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.9 0.381 . . . . 73.42 110.447 178.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.402 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 45.6 t -166.37 148.59 6.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 64.05 109.96 -177.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 1.047 ' HD2' ' HG ' ' A' ' 61' ' ' LEU . 4.9 t-80 -146.28 -170.54 3.52 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.483 -0.562 . . . . 75.51 109.483 176.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 55.5 m-85 101.39 -75.74 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.306 1.443 . . . . 72.44 111.412 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -125.56 8.03 7.65 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.174 -0.21 . . . . 72.24 111.272 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.7 tp 71.88 122.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.972 0.795 . . . . 64.43 111.913 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.402 ' OD1' ' HB3' ' A' ' 71' ' ' CYS . 6.1 p-10 -85.56 -40.3 16.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.677 -0.692 . . . . 64.33 110.894 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 61.35 21.17 11.75 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.89 -0.596 . . . . 53.43 111.242 -177.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -127.24 -53.0 1.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.355 0.598 . . . . 73.24 110.354 -175.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.3 t -75.76 -42.93 40.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.514 -0.767 . . . . 72.25 109.904 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.625 HD11 HD23 ' A' ' 84' ' ' LEU . 7.7 tp -66.05 -31.62 54.49 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.239 0 N-CA-C 109.604 -0.517 . . . . 41.02 109.604 174.369 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.6 -30.14 75.9 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.824 -0.703 . . . . 62.21 111.717 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.57 -27.62 51.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.086 0.469 . . . . 73.45 110.505 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.569 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 69.4 t80 -87.35 -45.41 10.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 65.1 111.817 -177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.625 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -74.9 -8.51 56.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.142 -0.481 . . . . 71.11 111.783 -172.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.815 -0.439 . . . . 65.24 109.815 175.082 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.5 mmt . . . . . 0 N--CA 1.478 0.936 0 N-CA-C 109.858 -0.423 . . . . 63.33 109.858 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.01 90.85 8.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.865 -0.421 . . . . 72.42 109.865 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -79.85 81.63 6.08 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.495 178.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -69.54 110.63 4.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.37 -0.832 . . . . 64.14 108.89 174.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.1 m -67.43 158.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 122.006 0.908 . . . . 74.15 112.539 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.24 156.85 68.88 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 113.869 -1.514 . . . . 73.42 109.994 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -86.83 174.4 5.6 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.435 2.09 . . . . 72.13 112.903 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD2' ' N ' ' A' ' 8' ' ' ARG . 2.0 mpt_? -107.58 -176.87 3.19 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.258 -1.015 . . . . 72.14 108.258 176.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.9 tmtp? -150.33 132.34 15.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.415 -0.587 . . . . 72.11 109.415 175.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.587 HD13 HD11 ' A' ' 61' ' ' LEU . 92.7 mt -127.77 138.96 52.92 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 63.22 110.57 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.51 HG22 ' HB3' ' A' ' 40' ' ' GLU . 77.0 t -114.88 137.84 47.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 62.31 110.08 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.608 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -110.14 113.48 44.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.997 0.427 . . . . 73.54 110.18 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.969 ' HB2' HG23 ' A' ' 60' ' ' VAL . 95.2 m-85 -87.11 128.33 35.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.929 -0.767 . . . . 73.52 108.929 174.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.526 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -172.82 -163.15 26.12 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.188 -1.006 . . . . 64.33 111.91 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 13.1 ptm180 -150.69 132.22 14.77 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.369 -0.604 . . . . 73.05 109.369 175.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.49 118.62 7.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.674 -0.694 . . . . 71.03 111.042 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.06 -20.68 1.94 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.38 -0.827 . . . . 64.2 111.601 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.3 p -96.43 128.83 43.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.795 0.331 . . . . 74.24 110.266 177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -69.33 -33.73 73.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.213 0.449 . . . . 74.42 112.213 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 73' ' ' TYR . 20.4 mt -58.61 -32.02 68.6 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.758 0.313 . . . . 75.32 111.258 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.86 -42.38 93.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 65.41 110.265 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.08 -45.49 91.85 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.111 -0.495 . . . . 74.11 110.386 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.452 ' OE2' HD23 ' A' ' 20' ' ' LEU . 45.6 mt-10 -61.89 -40.08 94.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.443 -0.799 . . . . 74.01 111.144 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.535 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.6 mtp -68.72 -49.19 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.241 -0.436 . . . . 62.52 110.698 177.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -58.77 -47.64 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-N 116.717 -0.22 . . . . 70.01 111.432 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -36.68 74.16 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.094 0.473 . . . . 53.23 111.076 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.6 m -69.72 -41.44 75.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.873 -0.603 . . . . 63.42 110.66 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 24' ' ' MET . 86.1 mt -66.66 -34.32 77.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.301 -0.408 . . . . 74.44 111.018 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -61.55 -41.84 97.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.34 111.236 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.71 -37.56 43.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.866 0.365 . . . . 75.14 110.596 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 1.5 mt -64.48 -31.93 73.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 71.2 110.887 178.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.584 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 32.3 mt-30 -52.52 -34.52 50.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.123 -0.49 . . . . 71.31 111.704 176.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -73.86 -23.97 59.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 72.52 111.357 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -93.65 -42.59 9.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.397 0.618 . . . . 73.23 109.965 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB2' HD13 ' A' ' 84' ' ' LEU . 69.9 m -143.54 104.03 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.924 -1.035 . . . . 73.43 109.198 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.7 t-105 -69.27 129.79 40.8 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.898 0.38 . . . . 71.44 111.702 -174.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 30.4 p90 -142.12 18.18 2.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.777 -0.647 . . . . 75.14 111.596 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 59.5 -179.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.032 0.444 . . . . 75.1 110.402 -177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.584 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.9 tp -153.14 132.19 12.6 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 120.099 -0.641 . . . . 72.33 110.808 170.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 7.7 tt0 -136.76 118.19 14.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.551 -0.537 . . . . 72.31 109.551 178.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -107.1 115.82 49.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.525 -0.546 . . . . 71.02 109.525 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.8 mt -115.83 119.69 62.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.775 -175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.539 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 12.0 m-80 -78.23 117.37 19.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 74.43 111.39 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.462 HG22 HD13 ' A' ' 50' ' ' LEU . 23.9 pt -81.01 -7.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 73.33 109.352 174.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -37.69 -46.97 0.94 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.25 -1.341 . . . . 64.15 113.329 -177.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.86 32.41 6.93 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.269 -0.967 . . . . 70.33 113.933 -175.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -139.08 100.28 3.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.069 0.435 . . . . 71.31 110.585 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HA ' ' HB ' ' A' ' 51' ' ' THR . 3.7 mp0 -55.38 -33.78 63.74 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.103 0.409 . . . . 73.12 112.103 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -56.89 -45.22 82.74 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.09 -0.337 . . . . 60.32 110.09 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.462 HD13 HG22 ' A' ' 44' ' ' ILE . 80.2 mt -78.64 -39.56 36.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.179 -0.464 . . . . 70.13 110.471 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.501 ' HB ' ' HA ' ' A' ' 48' ' ' GLU . 88.0 m -56.09 -54.03 49.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.194 -0.457 . . . . 54.53 111.679 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -59.06 -30.55 68.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.981 0.42 . . . . 74.21 110.972 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.9 mt -77.05 -53.82 7.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.078 -0.51 . . . . 55.32 111.906 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.451 ' HB2' HD13 ' A' ' 44' ' ' ILE . 59.3 m-85 -116.27 -0.2 12.68 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.487 1.292 . . . . 74.24 114.487 -165.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -59.35 -39.91 84.7 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.843 1.202 . . . . 74.41 111.163 -176.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -84.65 -14.42 48.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.792 -0.64 . . . . 74.24 110.951 178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.412 ' HG3' ' CE2' ' A' ' 73' ' ' TYR . 13.0 ttm180 -143.97 54.12 1.3 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.315 -0.624 . . . . 74.3 109.315 -167.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.584 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.26 -102.66 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.522 0 CA-C-O 118.444 -0.789 . . . . 72.34 111.069 -172.206 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.584 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 16.6 Cg_exo -23.17 75.06 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 122.567 2.178 . . . . 65.04 113.693 -145.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.969 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -102.05 115.51 44.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.719 . . . . 75.43 111.251 -169.229 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.608 HD23 HG22 ' A' ' 12' ' ' VAL . 3.0 tm? -89.19 110.25 21.03 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.572 -0.74 . . . . 61.34 109.587 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -92.25 127.15 37.63 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.111 -0.95 . . . . 72.33 110.693 -176.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.28 95.83 7.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.425 -0.807 . . . . 65.3 111.211 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.527 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 42.2 t -77.63 90.76 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.3 0.572 . . . . 72.21 109.487 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 22.8 t-20 172.19 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.844 -1.071 . . . . 70.1 108.659 -173.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -124.05 -2.59 8.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 64.24 109.928 -178.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 58.71 78.74 0.24 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.098 -0.955 . . . . 71.1 112.035 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -174.33 -179.41 1.59 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.39 -0.823 . . . . 75.32 110.332 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -95.09 141.78 28.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.45 -0.341 . . . . 62.22 110.777 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -96.02 -53.9 3.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.388 0.613 . . . . 73.31 109.559 170.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.7 t -156.77 155.47 31.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.312 -0.858 . . . . 71.44 109.374 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 3.6 p-80 -145.09 163.8 33.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.568 -0.287 . . . . 60.25 110.382 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.503 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 62.5 m-85 74.55 -56.63 0.63 Allowed 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.114 0.884 . . . . 71.5 110.951 -174.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -129.93 -161.95 1.16 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.007 -1.108 . . . . 71.14 108.007 -175.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.8 tp -129.85 113.48 14.71 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.079 -0.648 . . . . 54.41 111.886 -175.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -86.09 86.07 7.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.082 -0.71 . . . . 73.32 109.082 169.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.7 m -59.03 -28.23 66.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 64.22 111.381 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.46 -37.4 68.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.193 -0.458 . . . . 75.35 110.908 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 40.5 t -70.89 -46.59 67.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.193 -0.458 . . . . 70.33 110.977 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.512 HD11 HD11 ' A' ' 10' ' ' LEU . 6.9 tp -68.74 -28.18 38.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.346 -0.541 . . . . 64.42 109.992 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.78 -30.64 78.26 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 111.448 -0.661 . . . . 72.52 111.448 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.3 -33.03 64.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.187 0.517 . . . . 64.11 110.377 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -80.41 -51.42 8.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.96 -0.563 . . . . 71.35 111.038 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 35' ' ' SER . 13.3 mt -64.87 -50.93 64.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.707 -0.679 . . . . 62.24 111.516 -177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.576 0.548 . . . . 62.2 111.396 -172.943 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.8 ttp . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 120.671 0.272 . . . . 73.31 110.801 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -81.24 -54.55 5.4 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.042 -0.725 . . . . 72.54 109.042 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 48.3 t30 176.01 -84.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.956 -1.127 . . . . 75.13 107.956 176.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 24.8 tt0 167.16 80.15 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.444 1.09 . . . . 74.34 108.829 170.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.2 m -95.72 163.41 2.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.671 -0.492 . . . . 61.41 109.671 176.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 34.4 mt-10 -132.84 158.53 75.55 Favored Pre-proline 0 C--N 1.31 -1.114 0 CA-C-N 115.518 -0.764 . . . . 73.2 109.748 -176.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 45.3 Cg_endo -62.34 158.67 39.19 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.654 2.236 . . . . 71.23 113.329 -169.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.2 mmp_? -99.2 -164.36 1.12 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.935 -0.765 . . . . 54.43 108.935 175.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.965 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 4.3 tmtp? -149.76 128.87 12.73 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.544 -0.462 . . . . 70.32 110.858 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 37' ' ' PHE . 28.4 mt -116.78 138.67 51.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 64.44 111.294 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 40' ' ' GLU . 41.2 t -124.34 136.41 60.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.701 -0.681 . . . . 63.32 110.131 175.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.579 HG22 HD23 ' A' ' 61' ' ' LEU . 78.4 t -108.35 120.42 59.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.688 -0.486 . . . . 74.44 109.688 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -83.41 97.43 8.95 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.688 -0.486 . . . . 74.52 109.688 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.18 -176.12 14.3 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.018 -1.087 . . . . 52.42 112.696 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.748 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.2 ptm180 -158.28 125.44 4.98 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.896 -0.409 . . . . 74.42 109.896 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 55.3 -154.99 0.28 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.963 -0.562 . . . . 70.43 111.592 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.78 145.37 17.41 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.725 -0.75 . . . . 74.53 112.762 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.407 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 51.2 t -156.28 142.81 18.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.431 -0.581 . . . . 75.23 109.431 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 18.4 m170 -60.38 -48.8 80.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 62.5 111.772 -175.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -34.65 78.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.416 -0.356 . . . . 73.12 110.699 -175.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 84.2 m -64.7 -40.63 95.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.39 . . . . 43.13 110.493 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -61.93 -40.5 95.73 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.038 -0.528 . . . . 74.03 110.218 176.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 35.9 mt-10 -64.73 -36.39 84.14 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.726 -0.67 . . . . 71.12 110.942 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.574 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 82.6 mtp -67.26 -44.69 78.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.466 -0.334 . . . . 72.43 110.432 176.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.63 -47.39 82.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.821 0.343 . . . . 74.24 110.897 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.92 87.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.112 -0.495 . . . . 64.03 110.61 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -64.89 -42.33 94.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 71.21 110.887 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 24' ' ' MET . 95.9 mt -59.31 -45.59 90.89 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 116.164 -0.471 . . . . 60.42 110.569 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 28.1 mmm180 -57.73 -42.63 84.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.39 -0.368 . . . . 73.05 111.255 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 98.8 t -64.3 -45.41 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.287 -0.415 . . . . 45.32 111.137 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.95 -32.96 65.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.914 0.388 . . . . 62.41 110.146 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' LEU . 46.8 tt0 -62.78 -26.77 68.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.846 -0.616 . . . . 74.21 110.633 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 47.9 mtmt -63.36 -42.5 98.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.771 -0.65 . . . . 74.21 110.485 173.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -79.06 -37.61 38.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.056 -0.974 . . . . 64.04 110.639 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.632 ' HB3' HD12 ' A' ' 84' ' ' LEU . 46.1 m -145.66 124.68 12.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.527 -0.76 . . . . 75.23 109.628 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -83.72 119.49 24.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.312 0.577 . . . . 74.31 111.041 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.593 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 1.5 p90 -130.96 20.63 4.95 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.536 -0.756 . . . . 75.24 110.926 179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 9.8 mt-10 53.8 -176.83 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.349 0.595 . . . . 75.1 111.027 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.515 HD11 HD13 ' A' ' 28' ' ' LEU . 7.2 tp -152.17 134.9 15.46 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.186 -0.461 . . . . 72.21 110.031 173.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.675 ' HB3' HG22 ' A' ' 11' ' ' VAL . 10.3 tp10 -136.61 143.04 43.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.116 -0.493 . . . . 54.11 110.195 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.2 t -125.75 107.4 17.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.05 -0.722 . . . . 62.24 109.05 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.494 HD12 HG11 ' A' ' 11' ' ' VAL . 62.4 mt -107.86 116.28 50.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.721 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -75.92 106.67 7.63 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.344 -0.844 . . . . 73.33 110.251 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.4 pt -80.17 -9.83 12.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.62 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.59 -42.3 23.61 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.245 -0.889 . . . . 62.03 112.652 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.89 21.06 45.82 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.578 -0.82 . . . . 73.23 113.269 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 19.8 t-20 -129.72 119.62 23.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.028 0.414 . . . . 71.21 110.607 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.23 -20.66 60.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 72.14 111.929 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.402 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 26.8 m80 -77.6 -54.77 6.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.186 0.517 . . . . 74.41 110.363 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.0 mt -65.35 -39.75 92.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.622 -0.717 . . . . 73.32 111.432 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 83.4 m -61.47 -39.57 91.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.988 0.423 . . . . 75.32 110.788 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.07 -31.49 72.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.088 0.47 . . . . 72.34 110.512 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.67 -55.62 4.02 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.741 . . . . 71.32 111.695 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.453 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 49.2 m-85 -109.42 19.55 19.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.104 0.779 . . . . 71.14 113.104 -166.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.638 ' HB2' ' O ' ' A' ' 51' ' ' THR . 60.9 t30 -54.82 -47.48 74.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.175 0.512 . . . . 63.53 111.285 177.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.98 -17.6 56.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.113 -0.494 . . . . 73.41 111.169 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.513 ' HB2' HG23 ' A' ' 60' ' ' VAL . 9.3 ptt180 -128.26 73.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.073 0.464 . . . . 73.33 110.628 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.748 HG11 ' HG2' ' A' ' 15' ' ' ARG . 1.2 m -90.65 -22.6 0.26 Allowed Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 113.399 0.889 . . . . 63.52 113.399 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.505 ' HD3' HG23 ' A' ' 58' ' ' VAL . 3.8 Cg_exo -79.01 49.33 3.12 Favored 'Trans proline' 0 N--CA 1.443 -1.471 0 CA-C-N 120.629 1.26 . . . . 75.0 110.246 164.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.513 HG23 ' HB2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.01 131.44 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.198 -0.91 . . . . 64.44 110.16 -175.271 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.579 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -109.34 118.83 37.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.827 -0.624 . . . . 50.01 110.34 -174.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -106.67 136.71 46.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.004 -0.998 . . . . 73.1 110.842 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HG ' ' A' ' 70' ' ' LEU . . . -94.52 111.06 22.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.257 -0.428 . . . . 64.24 111.085 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.965 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 60.9 t -86.33 98.76 7.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.013 0.435 . . . . 71.22 109.994 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 54.2 t30 177.16 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.076 -1.083 . . . . 64.3 108.076 -176.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -106.16 -11.27 16.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.994 -1.003 . . . . 74.15 109.351 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 67.52 86.99 0.13 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 114.767 -1.106 . . . . 72.14 111.584 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -170.5 157.41 5.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.94 -1.027 . . . . 74.45 109.418 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -82.37 133.88 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.688 0.28 . . . . 73.23 110.399 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.496 ' HG ' ' HB2' ' A' ' 63' ' ' ALA . 53.7 mt -92.59 -46.56 7.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.016 0.436 . . . . 75.12 110.395 178.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.0 t -152.46 157.39 41.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.997 -0.547 . . . . 64.34 111.334 -171.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -128.36 128.82 45.25 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.859 -0.793 . . . . 75.43 108.859 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 59' ' ' PRO . 60.5 m-85 67.39 143.8 0.04 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.949 0.781 . . . . 63.34 112.021 -176.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 57.91 -124.16 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.752 -1.113 . . . . 71.02 110.519 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.0 tp -171.19 110.85 0.33 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.94 -0.304 . . . . 74.52 110.732 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.65 89.6 6.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.937 0.399 . . . . 74.11 110.069 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -57.71 -27.9 63.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.333 -0.849 . . . . 62.33 112.07 -176.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.18 -46.09 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 74.31 110.861 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.09 -44.83 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.51 . . . . 71.03 111.281 -176.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 10' ' ' LEU . 6.7 tp -64.99 -28.23 44.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.512 -0.475 . . . . 45.24 109.802 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.34 -36.27 89.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.75 -0.738 . . . . 61.02 111.662 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.98 -26.58 65.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.088 0.471 . . . . 61.11 110.785 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -87.92 -43.14 12.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 72.31 111.344 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.632 HD12 ' HB3' ' A' ' 35' ' ' SER . 1.3 mm? -76.07 -37.32 58.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.511 0.56 . . . . 75.34 112.511 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 121.156 -0.218 . . . . 55.34 110.934 -177.092 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 110.137 -0.32 . . . . 74.25 110.137 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -83.57 82.84 8.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.916 0.388 . . . . 75.04 111.543 -177.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -103.22 86.8 2.74 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.006 -1.109 . . . . 71.02 108.006 167.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -73.25 113.63 10.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.93 -1.032 . . . . 73.12 112.181 -166.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.7 m -110.73 147.62 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.514 -0.766 . . . . 72.55 109.845 169.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.486 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 7.4 pt-20 -88.81 161.92 40.04 Favored Pre-proline 0 C--N 1.31 -1.136 0 CA-C-N 115.222 -0.899 . . . . 64.21 110.416 -177.032 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 92.5 Cg_endo -80.35 167.04 19.79 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.513 2.142 . . . . 74.13 113.155 -172.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.596 ' NE ' ' O ' ' A' ' 85' ' ' SER . 80.7 mtt-85 -107.55 -171.92 1.97 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.419 -0.81 . . . . 72.34 109.522 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 48.8 tttt -149.52 139.43 21.93 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.117 -0.633 . . . . 74.02 112.141 -177.494 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 80' ' ' ILE . 71.2 mt -113.53 130.29 56.38 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.346 -0.843 . . . . 75.12 110.57 173.048 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.535 HG23 ' CG2' ' A' ' 64' ' ' VAL . 79.8 t -107.07 133.16 52.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.137 -0.69 . . . . 73.44 109.137 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.845 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 11.3 t -96.58 105.56 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 109.574 -0.528 . . . . 73.31 109.574 175.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.535 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 12.8 m-85 -78.23 98.71 5.98 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.933 -0.576 . . . . 75.22 110.256 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.643 ' HA2' ' HD3' ' A' ' 59' ' ' PRO . . . -114.31 -171.57 17.31 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.269 -0.967 . . . . 61.14 112.839 -175.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG2' HG11 ' A' ' 58' ' ' VAL . 10.1 ptm180 -161.97 103.42 1.15 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.766 -0.457 . . . . 72.43 109.766 171.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 73.82 -56.03 0.66 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.209 -0.905 . . . . 72.32 112.689 172.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.41 158.57 26.02 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.283 -0.961 . . . . 72.22 113.544 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.741 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 41.1 t -171.94 128.04 0.6 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.261 0.625 . . . . 74.23 109.8 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -68.0 -42.29 80.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.473 0.178 . . . . 72.34 111.286 -175.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 16.1 mt -61.83 -30.1 70.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.624 -0.262 . . . . 64.21 111.182 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.535 ' O ' HG13 ' A' ' 25' ' ' ILE . 51.4 t -55.93 -50.94 69.35 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.352 -0.24 . . . . 55.25 110.352 177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.24 -39.13 85.61 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.033 -0.531 . . . . 72.31 111.013 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.09 -39.34 89.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.841 -0.618 . . . . 73.43 111.136 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.436 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 15.2 mtp -71.9 -39.18 69.72 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.516 -0.474 . . . . 73.51 110.311 177.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 72.9 mt -54.84 -50.01 64.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 121.347 -0.141 . . . . 54.12 110.759 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.86 84.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.881 0.372 . . . . 74.3 111.17 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -66.96 -44.71 79.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.077 -0.51 . . . . 72.32 110.838 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.42 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 4.2 mm? -67.68 -32.18 72.66 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.32 -0.4 . . . . 72.22 111.31 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 10.0 mmm180 -57.98 -39.02 77.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.446 . . . . 65.13 110.814 178.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.464 ' HA ' ' CE ' ' A' ' 33' ' ' LYS . 80.4 t -67.84 -42.18 85.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.993 -0.549 . . . . 41.23 110.949 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.99 -35.08 77.74 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.808 -0.441 . . . . 75.44 109.808 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 35' ' ' SER . 23.7 tt0 -60.86 -26.59 67.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.584 -0.735 . . . . 63.43 110.656 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.464 ' CE ' ' HA ' ' A' ' 30' ' ' VAL . 54.3 mtmt -74.97 -11.23 60.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.636 -0.711 . . . . 71.11 111.383 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.11 -44.74 4.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 60.12 109.842 173.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 17.6 m -131.21 115.92 16.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.055 -177.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -77.24 132.64 38.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.123 0.487 . . . . 61.5 111.344 -177.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 16.6 p90 -139.99 19.0 2.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.708 -0.678 . . . . 55.15 111.062 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 9' ' ' LYS . 10.2 mm-40 60.82 -179.61 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.946 0.403 . . . . 64.24 111.286 -177.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -151.14 110.59 3.98 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.28 -0.637 . . . . 74.44 109.28 173.023 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -121.72 145.03 48.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.513 -0.312 . . . . 54.43 110.324 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.4 117.8 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.961 -0.385 . . . . 71.41 109.961 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -133.43 128.21 54.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.459 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.643 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 98.7 m-20 -83.54 128.71 34.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 63.32 110.46 176.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.2 pt -64.75 -47.51 88.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.208 -0.451 . . . . 70.51 109.994 175.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.43 ' N ' HG13 ' A' ' 44' ' ' ILE . 36.5 t70 44.57 -97.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.33 1.052 . . . . 74.32 113.629 173.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.09 -3.97 63.31 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.931 -0.652 . . . . 73.02 113.44 -171.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -80.93 84.35 6.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.75 -0.463 . . . . 71.21 109.75 178.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -53.27 -32.51 48.94 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 73.4 111.124 -177.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -55.4 -46.95 76.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.838 -0.619 . . . . 72.41 110.457 175.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.5 -39.88 36.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.273 -0.421 . . . . 71.24 110.876 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.609 ' HA ' HD12 ' A' ' 44' ' ' ILE . 6.9 m -56.34 -42.0 77.01 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.369 -0.378 . . . . 73.32 111.809 -177.603 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.22 -34.99 77.54 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.294 0.568 . . . . 72.2 111.095 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.9 mt -78.6 -48.52 14.98 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.442 -0.799 . . . . 74.43 111.33 -176.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.469 ' O ' HG13 ' A' ' 58' ' ' VAL . 62.4 m-85 -114.18 14.79 18.25 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.031 0.752 . . . . 71.32 113.031 -167.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.583 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.5 t-20 -53.45 -54.02 42.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.171 0.442 . . . . 52.4 111.3 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -87.8 -0.48 57.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.44 110.461 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.737 ' O ' HG22 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -108.52 5.26 25.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.716 -0.674 . . . . 73.35 110.647 -172.767 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.91 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 2.6 m -54.85 -171.24 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 114.804 1.409 . . . . 73.14 114.804 -163.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.91 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 17.6 Cg_exo -7.07 82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.428 -2.334 0 C-N-CA 122.507 2.138 . . . . 54.3 113.828 -129.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.845 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -90.53 160.26 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 122.551 0.341 . . . . 63.41 111.327 -171.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.574 HD23 HG22 ' A' ' 12' ' ' VAL . 24.6 mt -97.46 103.03 14.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.281 0.562 . . . . 62.14 109.707 169.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 70.2 t80 -93.68 128.3 39.8 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.056 -0.975 . . . . 71.25 110.777 -177.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.409 ' HB1' ' CE1' ' A' ' 83' ' ' TYR . . . -78.13 102.82 7.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.027 -0.533 . . . . 72.42 110.273 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.535 ' CG2' HG23 ' A' ' 11' ' ' VAL . 61.7 t -66.47 146.5 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.729 -0.669 . . . . 63.22 110.874 -176.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 93.7 m-20 81.0 -31.67 0.11 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.176 0.99 . . . . 73.01 112.729 176.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -98.76 -9.57 24.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 121.17 -0.212 . . . . 74.4 111.505 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 27.8 t70 48.08 73.47 0.21 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.48 0.657 . . . . 73.34 111.642 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -160.26 148.75 16.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 35.42 110.095 -177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -95.95 127.62 42.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.294 -0.632 . . . . 74.41 109.294 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.09 -70.12 0.59 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.622 -0.511 . . . . 65.43 109.622 177.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 50.0 t 178.16 140.38 0.09 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.385 -0.825 . . . . 64.24 108.936 177.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 21' ' ' CYS . 6.8 t60 -144.07 130.82 20.22 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.099 -0.64 . . . . 65.02 110.951 170.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.468 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 2.1 m-85 174.59 -70.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 125.314 1.634 . . . . 74.0 107.718 173.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 41.0 m-85 -114.12 -74.52 0.62 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 73.54 110.118 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 18.0 tp 175.64 141.95 0.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.532 0.333 . . . . 71.42 110.162 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -95.21 -42.52 8.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.387 -0.369 . . . . 65.45 110.617 176.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 m 62.19 20.74 11.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.741 -0.663 . . . . 74.03 111.932 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -139.06 -53.27 0.57 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.615 -0.434 . . . . 70.24 111.092 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.08 -39.25 82.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 73.11 109.71 177.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.58 HD11 HD11 ' A' ' 10' ' ' LEU . 8.1 tp -66.85 -34.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.937 -0.574 . . . . 62.44 109.835 174.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.49 -37.72 94.03 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.63 -0.795 . . . . 73.34 111.242 177.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.22 81.28 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.437 -0.382 . . . . 64.41 110.759 174.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.409 ' CE1' ' HB1' ' A' ' 63' ' ' ALA . 63.7 t80 -67.66 -43.68 79.68 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.087 -0.506 . . . . 65.13 111.72 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -71.26 13.76 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.327 0.491 . . . . 73.33 112.327 -173.378 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.596 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 18.8 m . . . . . 0 C--N 1.322 -0.602 0 N-CA-C 109.775 -0.454 . . . . 74.23 109.775 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.482 1.175 0 CA-C-O 120.644 0.259 . . . . 73.24 110.313 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -77.82 -58.14 3.42 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.472 -0.936 . . . . 70.53 108.472 173.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.474 ' OD1' ' HG3' ' A' ' 4' ' ' GLN . 25.7 t-20 -102.95 142.09 34.65 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.853 -1.165 . . . . 60.11 107.853 166.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.474 ' HG3' ' OD1' ' A' ' 3' ' ' ASN . 46.0 mt-30 68.75 102.07 0.06 Allowed 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 122.102 0.953 . . . . 70.04 110.088 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.4 m -113.95 -176.31 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-N 114.589 -1.187 . . . . 74.24 111.525 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -75.62 150.87 84.68 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.053 -0.976 . . . . 75.41 109.683 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -76.15 157.97 37.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.661 2.241 . . . . 72.35 113.196 -167.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 83' ' ' TYR . 48.7 mtt180 -95.1 -172.02 2.57 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.511 -0.768 . . . . 72.44 109.334 175.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.6 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 87.5 tttt -145.58 140.64 27.55 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.335 0.588 . . . . 73.02 111.685 -177.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.546 HD11 ' CD1' ' A' ' 80' ' ' ILE . 61.5 mt -116.91 129.71 56.24 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.092 -0.958 . . . . 74.21 110.427 174.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -105.82 126.66 61.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 116.017 -0.538 . . . . 74.13 109.784 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.672 HG22 HD23 ' A' ' 61' ' ' LEU . 95.9 t -96.95 114.53 34.14 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.137 -0.483 . . . . 73.33 109.949 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.499 ' HB2' HG23 ' A' ' 60' ' ' VAL . 51.9 m-85 -91.9 122.72 34.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 72.41 110.533 177.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.75 166.03 26.33 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 109.818 -1.313 . . . . 62.42 109.818 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -83.44 -68.82 0.68 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 118.414 1.107 . . . . 54.15 110.093 -178.24 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.473 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 1.8 mp0 -121.94 -77.24 0.59 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.2 -0.454 . . . . 44.11 110.114 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -154.04 154.91 25.83 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.389 -0.684 . . . . 52.33 111.389 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.8 t -162.5 145.66 11.32 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.843 -0.428 . . . . 51.12 109.843 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 32.8 m-70 -62.85 -36.19 82.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.696 -0.229 . . . . 65.14 111.215 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -32.39 72.61 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.861 0.363 . . . . 74.25 110.759 178.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 49.8 t -68.35 -42.1 79.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.217 -0.447 . . . . 60.55 109.8 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.37 -40.27 96.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.001 -0.545 . . . . 71.11 111.168 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.0 mm-40 -60.39 -47.06 87.73 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.109 0.481 . . . . 74.0 109.893 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.568 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.1 mtp -61.75 -49.66 75.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.732 -0.667 . . . . 74.44 111.373 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 75.0 mt -55.84 -45.63 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.854 -0.157 . . . . 71.32 111.4 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -37.15 78.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.986 0.422 . . . . 74.13 110.93 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.5 m -69.71 -38.4 76.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.61 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 24' ' ' MET . 82.3 mt -63.76 -39.29 93.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 53.52 110.828 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 1.0 OUTLIER -59.41 -38.29 80.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.097 0.475 . . . . 75.33 110.701 -179.237 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.96 -38.56 72.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.863 -0.608 . . . . 73.34 110.418 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -67.67 -32.65 73.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 74.32 111.438 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.5 mt-30 -59.63 -20.99 59.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.901 0.381 . . . . 63.34 111.432 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.73 -33.1 64.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 62.45 110.992 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.73 -38.64 11.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.171 0.51 . . . . 71.53 110.489 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.681 ' HB3' HD12 ' A' ' 84' ' ' LEU . 36.2 m -147.34 113.78 5.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.827 -0.624 . . . . 72.21 109.983 -177.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.84 128.54 33.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.025 0.441 . . . . 75.22 110.983 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.594 ' HB3' HD21 ' A' ' 84' ' ' LEU . 3.9 p90 -136.61 21.94 3.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.635 -0.711 . . . . 60.23 110.651 177.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.6 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 11.1 mm-40 58.51 -176.8 0.08 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.128 0.49 . . . . 64.05 110.576 -176.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.7 tp -152.62 109.84 3.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.4 -0.363 . . . . 72.14 110.197 170.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 42' ' ' ILE . 33.2 tt0 -121.31 118.73 30.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.046 -0.525 . . . . 63.23 109.593 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -106.9 112.31 39.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.612 -0.514 . . . . 64.43 109.612 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.414 HD11 ' OE2' ' A' ' 40' ' ' GLU . 65.9 mt -111.2 116.66 53.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.025 -0.534 . . . . 73.0 110.727 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.468 ' OD1' ' HA ' ' A' ' 16' ' ' GLU . 28.6 m-80 -76.55 116.98 17.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.809 -0.632 . . . . 64.43 111.06 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 17.9 pt -77.04 -38.65 28.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.965 -0.561 . . . . 74.45 109.83 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.403 ' H ' ' HA ' ' A' ' 15' ' ' ARG . 37.1 t70 32.33 -96.42 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.575 1.172 . . . . 71.13 112.988 -177.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.74 34.79 3.63 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.861 -0.685 . . . . 35.15 112.469 -177.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.418 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 26.5 t-20 -85.18 116.81 23.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.584 -0.525 . . . . 72.14 109.584 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -57.01 -25.05 57.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.849 0.685 . . . . 55.21 112.849 -174.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.418 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 92.5 m-70 -77.8 -58.09 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.354 -0.538 . . . . 72.41 110.768 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.5 mt -78.78 -39.58 35.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.61 0.596 . . . . 64.01 112.61 -172.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.597 ' HA ' HD12 ' A' ' 44' ' ' ILE . 87.9 m -60.69 -48.76 80.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.834 0.35 . . . . 73.14 110.966 -178.073 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -64.43 -29.39 70.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.916 0.389 . . . . 71.15 110.912 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.5 mt -80.09 -50.67 10.01 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.386 0.513 . . . . 75.3 112.386 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -109.04 -1.87 18.58 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.328 1.233 . . . . 74.14 114.328 -165.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -73.19 89.25 1.51 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.916 0.78 . . . . 72.21 112.004 -175.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -136.75 -85.42 0.33 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.308 -0.86 . . . . 72.34 109.177 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -139.59 81.44 1.83 Allowed 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 105.761 -1.941 . . . . 75.55 105.761 171.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.515 HG23 ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -51.09 -84.86 0.0 OUTLIER Pre-proline 0 CA--C 1.507 -0.685 0 CA-C-N 114.435 -1.257 . . . . 63.51 114.365 -157.203 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.515 ' HD3' HG23 ' A' ' 58' ' ' VAL . 51.0 Cg_exo -21.08 78.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.569 0 C-N-CA 122.718 2.279 . . . . 64.01 114.223 -144.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -99.56 133.41 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.592 -0.731 . . . . 75.43 111.267 -170.374 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.672 HD23 HG22 ' A' ' 12' ' ' VAL . 58.1 mt -88.27 106.48 18.24 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.294 0.568 . . . . 72.13 109.694 170.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -91.31 121.97 33.52 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.309 -0.86 . . . . 74.24 109.868 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.5 100.89 6.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.85 -0.614 . . . . 34.32 110.465 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 52.8 t -67.89 161.57 3.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.315 -0.624 . . . . 75.44 109.315 177.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 32.1 m-80 79.68 -46.81 0.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.184 0.594 . . . . 74.23 111.618 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -94.3 -26.39 16.61 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.807 0.337 . . . . 73.53 110.258 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 60.99 82.21 0.17 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.316 -0.856 . . . . 72.51 111.791 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -165.11 166.41 19.13 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.261 -0.881 . . . . 72.24 110.112 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -94.17 127.98 40.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 72.44 110.393 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.4 mt -100.91 -82.19 0.46 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.537 0.684 . . . . 61.1 111.733 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 37.8 t -135.8 148.69 48.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.167 -0.924 . . . . 53.42 110.65 -169.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -145.2 163.19 35.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.74 -0.209 . . . . 75.14 111.236 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 82.85 -77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.616 0.969 . . . . 70.44 113.616 171.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -114.46 -0.35 13.78 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.737 0.643 . . . . 75.25 112.737 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.6 tp 66.93 108.27 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.673 . . . . 64.01 111.371 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -80.68 -21.8 40.99 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 54.12 110.8 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.7 m 70.82 -54.19 0.66 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.704 0.627 . . . . 75.2 111.809 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -60.39 -45.6 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.005 0.372 . . . . 63.41 112.005 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.13 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 75.44 111.977 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.839 HD11 HD23 ' A' ' 84' ' ' LEU . 5.5 tp -71.84 -34.53 51.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 C-N-CA 120.3 -0.56 . . . . 71.32 109.804 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.35 -35.25 90.69 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.649 -0.786 . . . . 45.13 111.731 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.32 72.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.984 0.421 . . . . 64.44 111.191 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.456 ' CZ ' ' HD3' ' A' ' 8' ' ' ARG . 20.2 t80 -87.76 -47.73 8.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.452 . . . . 71.21 111.712 178.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.839 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -69.46 -37.43 77.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.102 -0.499 . . . . 71.41 111.889 -171.396 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 110.487 -0.19 . . . . 75.31 110.487 -179.329 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.0 mtm . . . . . 0 N--CA 1.483 1.223 0 N-CA-C 109.661 -0.496 . . . . 73.25 109.661 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -74.2 49.15 0.34 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.405 0.621 . . . . 74.22 111.042 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -112.04 96.65 6.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.618 -0.719 . . . . 72.31 109.478 -177.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -70.45 122.87 20.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.032 0.92 . . . . 73.22 111.409 -175.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.1 m -124.61 119.72 56.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 114.631 -1.168 . . . . 64.43 108.98 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -129.89 153.67 80.98 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.129 -0.487 . . . . 70.23 110.935 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.35 152.9 61.35 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.871 2.381 . . . . 62.33 113.282 -173.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' ' O ' ' A' ' 85' ' ' SER . 2.4 ptp180 -115.24 150.04 36.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.264 -0.88 . . . . 74.23 108.64 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.615 ' HG2' ' HG3' ' A' ' 38' ' ' GLU . 47.1 mtpt -100.38 135.96 41.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.643 0.609 . . . . 75.45 112.643 -172.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.714 HD11 HD11 ' A' ' 80' ' ' ILE . 73.5 mt -103.63 130.52 51.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.372 -0.831 . . . . 65.44 110.038 170.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -107.9 128.64 63.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.445 175.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.517 HG22 HD23 ' A' ' 61' ' ' LEU . 86.2 t -96.46 119.5 44.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 109.106 -0.701 . . . . 74.43 109.106 174.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB2' HG12 ' A' ' 60' ' ' VAL . 4.6 m-85 -78.47 97.02 5.55 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.015 0.436 . . . . 73.1 110.811 -179.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.542 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -80.44 160.62 43.98 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.81 -0.71 . . . . 72.31 112.539 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 1.011 ' HB2' HG11 ' A' ' 58' ' ' VAL . 34.9 ttp180 -144.94 -0.67 0.89 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.077 -0.712 . . . . 74.14 109.077 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 59.18 170.66 0.07 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 114.731 -1.122 . . . . 62.22 111.033 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.23 -56.94 4.88 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.808 -0.711 . . . . 52.13 113.632 175.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.17 113.47 6.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.085 0.469 . . . . 73.22 110.97 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -71.46 -28.29 63.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.871 -0.604 . . . . 74.41 111.198 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 73' ' ' TYR . 18.6 mt -54.4 -30.19 51.36 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.624 0.231 . . . . 75.22 111.624 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.417 ' O ' HG13 ' A' ' 25' ' ' ILE . 71.0 m -56.08 -38.74 71.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.671 0.272 . . . . 71.42 110.731 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -71.29 -33.46 69.75 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.731 0.3 . . . . 75.23 110.629 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LEU . 8.3 mm-40 -56.24 -45.05 80.17 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.081 -0.509 . . . . 71.33 110.077 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.616 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.7 mmm -67.0 -41.47 86.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.517 -0.765 . . . . 43.25 110.137 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 21' ' ' CYS . 79.1 mt -56.82 -45.26 83.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 115.938 -0.573 . . . . 71.05 110.805 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.45 87.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.903 0.382 . . . . 75.11 110.69 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -61.59 -42.86 99.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 54.2 110.958 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 24' ' ' MET . 73.8 mt -64.06 -37.6 88.04 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.209 -0.45 . . . . 72.41 110.915 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -61.24 -42.4 98.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.254 -0.43 . . . . 75.03 110.893 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.567 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 97.9 t -71.61 -39.43 69.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.622 178.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HA ' HD23 ' A' ' 31' ' ' LEU . 14.2 mt -66.71 -34.79 78.62 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.377 -0.374 . . . . 72.21 111.443 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.87 -20.99 60.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 72.43 111.37 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.9 mtmt -82.02 -15.86 52.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.04 111.191 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -106.43 -46.2 4.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.481 0.658 . . . . 71.33 109.743 178.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.9 m -141.19 113.22 7.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.884 -1.053 . . . . 72.15 109.319 -175.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -79.22 129.22 34.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.989 0.423 . . . . 64.52 111.7 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' A' ' 84' ' ' LEU . 3.1 p90 -138.27 18.42 2.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.997 -0.547 . . . . 74.4 111.282 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.615 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 12.0 mm-40 57.84 -178.55 0.06 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.329 0.585 . . . . 73.11 111.159 -176.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.8 tp -150.7 117.3 5.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.053 -0.521 . . . . 74.22 110.36 171.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB3' HG22 ' A' ' 11' ' ' VAL . 29.7 tt0 -126.47 123.51 38.0 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.557 -0.747 . . . . 71.25 109.568 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.1 t -104.74 120.25 54.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.472 -0.331 . . . . 43.3 110.153 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 11' ' ' VAL . 75.7 mt -124.71 110.41 24.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.381 -0.372 . . . . 62.52 110.333 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.2 m120 -69.62 122.81 19.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.265 0.555 . . . . 75.23 111.829 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.584 HD13 ' HB2' ' A' ' 54' ' ' TYR . 44.8 pt -86.57 -10.05 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.856 -0.611 . . . . 61.41 110.445 178.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.436 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 5.6 p-10 -73.53 -7.12 50.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.014 0.435 . . . . 74.23 110.32 177.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.36 -2.95 58.83 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.156 -0.778 . . . . 74.33 111.156 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -131.59 97.52 4.25 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.426 -0.583 . . . . 63.11 109.426 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.92 -24.67 67.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.307 0.855 . . . . 54.34 113.307 -169.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -75.27 -41.67 56.73 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.231 -0.588 . . . . 64.12 110.171 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.91 -31.5 72.7 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.51 -0.313 . . . . 75.5 110.594 173.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.479 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 45.5 m -53.43 -57.16 11.62 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.069 -0.514 . . . . 53.45 111.326 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.0 mtt-85 -63.93 -31.28 72.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.025 0.44 . . . . 65.32 111.62 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.7 mt -68.11 -39.86 82.69 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.333 0.494 . . . . 70.43 112.333 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.584 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.5 m-85 -131.47 19.34 4.77 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 112.44 0.533 . . . . 75.42 112.44 -172.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 51' ' ' THR . 45.2 t30 -52.13 -53.35 43.8 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.051 0.453 . . . . 74.41 111.846 -176.67 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -93.25 11.88 26.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.749 -0.659 . . . . 72.5 110.365 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.724 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 72.7 mtm180 -135.49 50.82 2.1 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.773 -0.825 . . . . 75.33 108.773 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.011 HG11 ' HB2' ' A' ' 15' ' ' ARG . 1.4 m -89.27 -24.28 0.29 Allowed Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 114.078 1.14 . . . . 75.15 114.078 -178.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.905 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 8.3 Cg_exo -75.08 52.02 2.97 Favored 'Trans proline' 0 N--CA 1.44 -1.64 0 CA-C-N 121.025 1.402 . . . . 74.01 110.039 165.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.4 OUTLIER -111.46 150.53 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 CA-C-N 114.893 -1.049 . . . . 73.33 110.141 -171.048 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 70' ' ' LEU . 91.6 mt -113.28 122.14 46.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.896 0.379 . . . . 63.03 111.18 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.552 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 91.2 t80 -99.61 125.26 45.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.965 -0.561 . . . . 73.51 109.931 175.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.644 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . . . -84.88 106.95 16.78 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.895 0.379 . . . . 74.41 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.3 t -78.89 93.83 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.04 -0.527 . . . . 65.24 110.093 177.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 33.9 t-20 170.89 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 72.43 109.206 -177.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -119.64 -11.63 9.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.596 -0.729 . . . . 74.12 111.026 -176.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 66.69 89.57 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.429 0.633 . . . . 75.44 109.725 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 63' ' ' ALA . 19.3 ptmt -167.9 150.57 5.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 72.54 109.913 -175.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.76 135.41 34.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.753 -0.462 . . . . 64.23 109.753 175.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 3.1 mm? -79.14 -70.99 0.47 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.779 -0.646 . . . . 53.15 110.496 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.492 ' SG ' HD12 ' A' ' 75' ' ' LEU . 8.4 p -152.97 -178.91 7.21 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.388 -0.824 . . . . 71.43 110.101 -178.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -118.38 -170.93 1.98 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.851 -0.613 . . . . 53.43 110.242 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.905 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 21.1 p90 -41.9 135.16 2.43 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 123.769 0.668 . . . . 74.52 111.378 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.486 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 56.6 m-85 71.87 94.13 0.08 Allowed 'General case' 0 C--O 1.231 0.127 0 O-C-N 124.119 0.887 . . . . 73.3 109.353 -173.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.492 HD12 ' SG ' ' A' ' 71' ' ' CYS . 38.4 tp -53.58 123.86 13.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.07 -1.423 . . . . 72.33 113.849 -166.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 71' ' ' CYS . 4.4 m-20 -80.9 94.24 6.45 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.081 -1.081 . . . . 72.11 108.081 167.054 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.1 m -67.85 -36.43 80.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 72.52 111.515 -169.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.55 -43.46 98.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.341 . . . . 54.32 111.228 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.2 -46.92 86.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.159 -0.473 . . . . 62.03 111.598 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.714 HD11 HD11 ' A' ' 10' ' ' LEU . 7.8 tp -66.93 -37.22 78.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.034 -0.666 . . . . 71.42 110.431 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.85 -37.2 93.31 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.578 -0.82 . . . . 53.52 111.661 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -47.46 83.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.879 0.371 . . . . 75.24 110.843 177.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -72.6 -34.25 67.27 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.002 -0.545 . . . . 74.52 111.767 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -84.41 11.05 9.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.409 -0.359 . . . . 75.45 111.859 -174.889 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.774 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.162 -0.681 . . . . 65.43 109.162 172.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.993 0.425 . . . . 74.54 110.454 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -123.76 -32.81 3.26 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.013 -0.539 . . . . 74.12 110.089 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -123.73 151.02 43.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.213 -0.448 . . . . 71.23 111.267 -177.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -123.46 156.39 35.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.854 -0.612 . . . . 54.41 109.48 175.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -99.89 178.58 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.175 0.512 . . . . 54.51 111.463 -177.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.7 pt-20 -112.96 168.16 8.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.0 -1.0 . . . . 74.3 109.324 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 74.4 Cg_endo -73.8 154.51 48.73 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.057 1.838 . . . . 60.43 113.153 -174.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.899 ' NH1' ' O ' ' A' ' 85' ' ' SER . 9.5 ptp180 -109.54 116.22 31.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.746 -0.661 . . . . 73.15 109.602 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 82.7 tttt -74.78 140.12 43.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.877 0.695 . . . . 74.21 112.877 -168.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.694 HD11 HD11 ' A' ' 80' ' ' ILE . 32.8 mt -113.08 145.89 40.12 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.203 -0.908 . . . . 74.34 110.736 172.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.9 t -119.73 138.53 50.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.004 -0.544 . . . . 71.31 109.937 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.651 HG22 HD23 ' A' ' 61' ' ' LEU . 65.9 t -113.57 119.97 62.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 N-CA-C 110.165 -0.309 . . . . 74.43 110.165 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 1.024 ' HB2' HG23 ' A' ' 60' ' ' VAL . 63.8 m-85 -83.64 113.87 21.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.526 -0.546 . . . . 75.31 109.526 174.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -124.01 -173.74 13.97 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.617 -0.593 . . . . 74.22 111.617 -177.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' HB2' ' A' ' 45' ' ' ASP . 6.2 ptm85 -159.2 154.89 26.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.821 0.343 . . . . 74.31 110.715 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -73.44 72.62 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.541 -0.754 . . . . 71.12 109.686 174.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.56 61.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.672 -0.695 . . . . 73.45 111.926 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.4 t -172.06 114.37 0.33 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.889 -0.782 . . . . 50.25 108.889 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -70.99 -35.46 72.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.345 -0.389 . . . . 65.14 111.826 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -52.95 -29.2 27.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.929 0.714 . . . . 63.25 112.929 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 62.6 m -54.99 -32.93 62.12 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.623 0.249 . . . . 73.02 111.045 178.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -64.15 -50.34 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.381 -0.372 . . . . 63.24 110.401 178.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -55.12 -49.44 71.75 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.518 -0.764 . . . . 54.15 111.241 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.549 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 63.7 mtp -59.09 -54.28 48.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 71.11 111.115 -179.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.69 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 84.1 mt -56.12 -50.59 69.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 73.52 111.407 -177.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -37.81 73.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.958 0.409 . . . . 72.42 111.142 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.4 m -69.11 -43.48 74.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 65.54 110.879 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 24' ' ' MET . 80.4 mt -65.38 -38.38 89.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.03 111.424 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 11.5 mmm180 -58.07 -35.65 71.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 71.34 111.01 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.7 t -77.32 -32.71 19.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.328 -0.396 . . . . 74.44 110.608 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -30.68 66.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.037 0.446 . . . . 75.23 109.859 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.6 mt-30 -59.93 -20.83 59.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.88 -0.6 . . . . 71.41 111.252 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -81.21 -15.54 55.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 63.12 110.855 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -96.97 -49.29 5.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.319 -0.623 . . . . 65.32 109.319 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 17.9 m -140.88 119.8 12.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.025 -0.989 . . . . 72.34 109.366 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -79.26 131.68 36.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.039 0.447 . . . . 74.44 110.618 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' HD12 ' A' ' 10' ' ' LEU . 9.1 p90 -139.15 16.58 2.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.806 -0.634 . . . . 73.4 111.582 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.501 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 15.6 mm-40 59.94 178.5 0.09 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.991 0.424 . . . . 72.24 110.611 -176.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.9 tp -153.19 110.12 3.45 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 120.264 -0.574 . . . . 72.43 110.88 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -115.87 118.63 33.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.97 -0.559 . . . . 72.42 109.97 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -105.4 113.84 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 110.085 -0.339 . . . . 40.11 110.085 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.7 mt -113.05 114.85 48.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.148 -0.478 . . . . 74.44 110.869 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -73.04 118.24 15.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.659 -0.701 . . . . 72.53 111.509 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.524 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.9 pt -86.11 -25.27 6.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.07 -0.514 . . . . 73.33 111.804 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 32.9 t70 -67.49 -23.51 65.49 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.978 0.418 . . . . 73.31 111.55 -172.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.89 19.38 30.11 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.993 -0.622 . . . . 74.24 111.828 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -142.27 119.39 11.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.378 -0.601 . . . . 54.22 109.378 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -55.52 -37.52 68.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 62.42 111.26 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.51 -52.75 9.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.158 -0.473 . . . . 65.13 110.966 -174.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.428 HD23 HD12 ' A' ' 53' ' ' LEU . 48.4 mt -64.11 -33.73 76.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.519 -0.31 . . . . 61.22 111.573 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.57 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 88.1 m -57.85 -53.21 60.77 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 120.845 0.355 . . . . 64.54 110.368 175.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.88 -31.48 72.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.27 -0.423 . . . . 74.31 111.402 -178.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 50' ' ' LEU . 72.1 mt -71.55 -48.35 49.08 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.381 0.512 . . . . 54.5 112.381 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.555 ' CD2' HG21 ' A' ' 60' ' ' VAL . 89.6 m-85 -113.94 8.59 17.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.28 0.844 . . . . 75.32 113.28 -169.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.57 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.2 t30 -59.66 135.86 57.81 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.398 -0.521 . . . . 75.04 111.478 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.3 t70 74.86 -30.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 71.44 112.903 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.494 ' HG2' ' OH ' ' A' ' 73' ' ' TYR . 82.8 mtt180 -116.03 37.24 3.73 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 108.364 -0.976 . . . . 75.15 108.364 -175.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.604 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.67 -97.57 0.0 OUTLIER Pre-proline 0 N--CA 1.425 -1.717 0 CA-C-N 115.276 -0.875 . . . . 74.5 110.228 -176.228 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.604 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 65.8 Cg_exo -17.74 75.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 122.535 2.157 . . . . 61.25 113.288 -146.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 1.024 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -111.3 126.16 68.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.916 -1.038 . . . . 70.42 111.699 -165.546 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.651 HD23 HG22 ' A' ' 12' ' ' VAL . 21.5 mt -89.62 112.87 24.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.882 -0.599 . . . . 75.21 110.72 176.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.592 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.0 t80 -91.79 120.28 32.37 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.522 -0.763 . . . . 71.52 109.761 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.87 102.82 11.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.945 -0.57 . . . . 50.32 110.196 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 50.0 t -63.94 146.83 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.145 -0.687 . . . . 64.34 109.145 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 49.8 m-80 85.18 -29.06 0.08 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.157 0.983 . . . . 70.32 111.047 -177.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.699 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 28.0 mt-10 -96.7 -37.01 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.26 -0.176 . . . . 74.51 111.236 176.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.592 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 18.2 t70 68.93 77.77 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.791 0.682 . . . . 75.35 109.896 -176.239 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.699 ' HD3' ' HB3' ' A' ' 66' ' ' GLU . 16.4 ptmt -179.77 157.82 0.75 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.36 -0.837 . . . . 73.14 109.674 -174.161 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mp0 -94.9 141.19 28.93 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.566 -0.531 . . . . 73.15 109.566 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 63.4 mt -84.07 -66.16 0.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.447 0.642 . . . . 74.21 110.036 176.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 19.3 t -144.29 170.76 15.39 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.865 -0.791 . . . . 74.51 108.865 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.546 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 1.5 p-80 -144.36 174.65 10.73 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 123.006 0.191 . . . . 62.52 111.503 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.494 ' OH ' ' HG2' ' A' ' 57' ' ' ARG . 18.2 m-85 80.05 -81.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.173 0.989 . . . . 74.25 112.256 178.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.549 ' O ' ' HG2' ' A' ' 24' ' ' MET . 56.0 m-85 -112.37 -84.5 0.58 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 121.023 -0.271 . . . . 62.33 110.846 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.4 tp 178.35 147.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.126 -0.488 . . . . 62.22 110.016 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.525 ' O ' HG22 ' A' ' 80' ' ' ILE . 18.6 t70 -141.12 109.74 5.99 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.498 -0.556 . . . . 73.44 109.498 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 -27.88 69.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.829 -0.623 . . . . 72.43 111.659 -174.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -73.84 -49.53 24.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.967 -0.56 . . . . 65.24 111.446 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.21 -46.97 89.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 45.32 111.796 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.694 HD11 HD11 ' A' ' 10' ' ' LEU . 7.0 tp -69.42 -30.5 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.856 -0.737 . . . . 53.21 109.985 177.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.59 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . -65.42 -19.97 67.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.047 -0.597 . . . . 53.22 111.8 176.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.79 -35.21 60.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.127 0.489 . . . . 63.45 110.231 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -86.53 -40.12 15.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 73.41 111.057 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.595 HD23 HD11 ' A' ' 80' ' ' ILE . 1.7 mm? -85.74 13.51 7.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.4 -0.363 . . . . 71.14 111.404 -178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.899 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 4.4 t . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.502 -0.555 . . . . 75.31 109.502 176.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.815 0.341 . . . . 54.44 110.339 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -145.34 116.86 8.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.299 -0.63 . . . . 74.2 109.299 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -122.72 132.42 54.24 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.882 0.372 . . . . 73.02 110.558 -178.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -132.53 161.32 34.1 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.522 -0.547 . . . . 75.42 109.522 179.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.6 m -92.88 178.36 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.115 0.483 . . . . 75.42 110.255 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -105.11 156.97 35.29 Favored Pre-proline 0 C--N 1.316 -0.861 0 CA-C-N 115.755 -0.657 . . . . 74.23 109.911 179.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.99 121.28 4.43 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.632 2.221 . . . . 62.34 112.477 -175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -102.99 119.08 38.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.426 -0.806 . . . . 70.53 109.741 177.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 57.6 mtpt -73.03 139.0 46.29 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.992 -0.549 . . . . 74.02 112.239 -172.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.597 HD11 HD11 ' A' ' 80' ' ' ILE . 22.3 mt -105.77 119.12 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.286 -0.87 . . . . 72.12 109.923 170.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 40' ' ' GLU . 80.9 t -102.07 129.89 52.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.868 -0.605 . . . . 43.15 109.982 177.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.531 HG22 ' CD2' ' A' ' 61' ' ' LEU . 46.3 t -96.33 107.06 19.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 116.068 -0.515 . . . . 61.33 109.731 176.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 1.069 ' HB2' HG23 ' A' ' 60' ' ' VAL . 20.2 m-85 -81.48 116.89 21.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.396 -0.594 . . . . 63.32 109.396 174.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -147.93 -151.8 5.53 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.286 -0.726 . . . . 62.43 111.286 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.415 ' HE ' ' HB2' ' A' ' 15' ' ' ARG . 5.4 ptm180 -171.26 164.64 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.96 0.41 . . . . 73.4 110.743 176.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.13 131.09 48.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.531 -0.759 . . . . 74.41 110.704 175.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.81 -7.55 55.44 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 23.13 112.863 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -104.53 102.87 12.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.123 0.487 . . . . 73.12 109.827 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -64.61 -33.11 75.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.717 -0.674 . . . . 74.32 110.634 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -59.31 -31.57 69.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.389 -0.369 . . . . 71.32 111.56 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.471 ' O ' HG13 ' A' ' 25' ' ' ILE . 68.3 m -61.04 -42.04 97.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.977 0.418 . . . . 62.54 110.32 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -70.53 -35.13 72.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.02 -0.536 . . . . 63.33 110.47 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.49 -34.34 77.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.733 -0.667 . . . . 73.12 110.686 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.1 mtt -64.54 -43.97 92.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.098 -0.501 . . . . 72.31 110.893 173.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.6 mt -54.68 -53.25 33.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.315 -0.402 . . . . 75.54 110.92 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.18 -31.07 68.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.444 -0.344 . . . . 74.1 111.416 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.7 m -73.33 -46.24 50.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.216 -0.447 . . . . 72.11 110.721 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.478 HD11 HD11 ' A' ' 61' ' ' LEU . 9.2 mp -64.94 -35.91 82.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.197 -0.456 . . . . 75.03 111.604 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -56.61 -34.06 66.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.013 0.435 . . . . 75.32 111.257 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.59 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.7 t -76.79 -40.23 31.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.086 -0.506 . . . . 73.23 110.748 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.423 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -62.81 -34.71 77.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.525 -0.307 . . . . 75.04 111.024 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -53.93 -29.34 41.86 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.49 0.494 . . . . 72.11 111.444 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 54.7 mtmt -77.23 -11.76 59.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.888 -0.596 . . . . 75.34 111.391 -176.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -108.81 -45.84 3.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.527 0.68 . . . . 71.1 109.496 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.562 ' HB3' HD12 ' A' ' 84' ' ' LEU . 44.4 m -137.39 124.08 21.08 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.02 -0.991 . . . . 74.42 109.629 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -84.23 134.25 34.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.065 0.459 . . . . 75.43 111.597 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 9.5 p90 -147.79 18.23 1.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.769 -0.651 . . . . 71.52 110.957 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 27.2 mm-40 58.53 -169.26 0.13 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.561 -0.29 . . . . 72.44 110.468 -177.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.62 131.03 13.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.796 -0.446 . . . . 61.12 109.796 175.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.603 ' HB3' HG22 ' A' ' 11' ' ' VAL . 5.1 tt0 -146.36 128.23 15.4 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.565 -0.532 . . . . 72.33 109.565 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.2 t -118.9 119.39 60.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.892 -0.41 . . . . 71.34 109.892 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.448 HD12 HG11 ' A' ' 11' ' ' VAL . 71.3 mt -127.7 126.15 66.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.466 -0.334 . . . . 74.03 110.971 -174.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 94.8 m-20 -76.98 126.95 31.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.591 . . . . 71.4 111.094 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' CG1' ' A' ' 58' ' ' VAL . 2.7 pp -79.06 -23.64 12.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 74.52 111.52 -178.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -79.17 -5.48 54.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 72.21 111.067 -175.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.69 -6.58 63.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.791 -0.719 . . . . 71.04 111.762 174.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -127.19 123.92 37.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.653 0.263 . . . . 75.45 110.85 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -50.92 -47.37 60.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 71.22 111.492 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -61.12 -48.88 79.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.386 . . . . 75.5 110.818 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.0 mt -73.23 -31.38 64.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.964 -0.562 . . . . 63.35 111.694 -172.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 55' ' ' ASN . 31.1 m -61.26 -51.69 67.89 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 121.16 0.505 . . . . 73.34 110.334 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -61.11 -30.74 70.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.916 -0.584 . . . . 71.22 111.112 -177.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.77 -34.27 24.82 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.034 0.753 . . . . 72.52 113.034 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -135.85 10.97 3.38 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.443 -0.503 . . . . 70.33 112.283 -165.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 51' ' ' THR . 2.7 p-10 -46.07 -39.09 8.81 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.251 0.834 . . . . 70.12 113.251 -172.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -131.0 21.6 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.641 0.734 . . . . 72.44 110.932 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.1 ttm180 -146.17 44.4 1.24 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.528 -1.286 . . . . 71.13 107.528 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.572 ' CG1' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.2 -98.1 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.52 0 CA-C-N 115.199 -0.91 . . . . 54.21 111.275 -171.885 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.705 ' O ' ' HA ' ' A' ' 72' ' ' HIS . 73.0 Cg_exo -20.17 76.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.29 0 C-N-CA 122.504 2.136 . . . . 74.15 113.646 -145.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 1.069 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -110.42 121.28 62.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 115.24 -0.891 . . . . 65.3 111.179 -170.521 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.531 ' CD2' HG22 ' A' ' 12' ' ' VAL . 38.9 mt -83.25 107.55 15.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.15 -0.477 . . . . 71.2 110.742 176.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -92.33 122.54 34.89 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.829 -0.623 . . . . 64.25 110.418 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.08 102.35 10.96 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.728 -0.669 . . . . 61.42 111.208 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 9' ' ' LYS . 29.4 t -81.15 87.29 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.306 0.574 . . . . 54.03 110.184 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 23.5 t-20 172.32 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.764 -1.107 . . . . 75.12 108.233 -179.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -99.15 -19.54 17.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.879 -1.055 . . . . 75.13 109.862 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.7 t70 67.37 78.41 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.122 -0.945 . . . . 72.12 111.029 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.98 149.32 0.9 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.042 -0.526 . . . . 73.53 110.445 174.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.57 140.09 34.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.941 -0.572 . . . . 73.13 110.415 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -91.6 -81.63 0.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.02 0.438 . . . . 75.32 110.838 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.4 p -122.82 164.45 18.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.113 -0.494 . . . . 43.34 109.85 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.705 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 10.2 p80 -144.83 168.03 21.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.43 0.53 . . . . 54.41 112.43 -176.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 26.2 m-85 74.74 -82.5 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.241 1.016 . . . . 72.35 112.231 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 22.9 m-85 -99.48 -79.51 0.49 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.77 -0.372 . . . . 75.14 110.512 -176.51 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 22.2 tp 171.21 147.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.888 0.743 . . . . 54.35 109.716 176.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -123.68 115.37 21.32 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.675 -0.861 . . . . 71.31 108.675 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.7 p -82.04 -2.63 52.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.981 -0.554 . . . . 74.22 112.364 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -107.43 -39.45 5.64 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.94 -0.304 . . . . 72.21 111.092 -176.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.72 -45.04 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.601 -0.272 . . . . 60.5 110.69 176.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.597 HD11 HD11 ' A' ' 10' ' ' LEU . 7.3 tp -68.34 -31.47 51.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.532 -0.467 . . . . 54.22 110.09 176.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.12 -34.51 86.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.646 -0.788 . . . . 62.44 111.704 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.95 -36.7 72.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.987 0.422 . . . . 62.23 110.492 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -81.34 -47.25 13.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.898 -0.592 . . . . 63.2 111.837 -177.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.562 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.3 OUTLIER -79.11 13.41 1.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.08 0.4 . . . . 71.21 112.08 -172.045 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.765 -0.457 . . . . 65.14 109.765 176.536 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 N--CA 1.449 -0.511 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -81.39 173.95 11.09 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.786 2.324 . . . . 0.0 113.044 -171.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -103.75 140.47 37.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.562 ' HD3' ' HB2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -86.66 146.96 26.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 -176.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 61' ' ' LEU . 96.3 mt -122.16 137.65 54.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.355 0.598 . . . . 0.0 111.216 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.531 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -119.35 139.62 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.144 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 53.0 t -110.89 114.01 45.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 120.923 0.392 . . . . 0.0 110.133 175.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.761 ' HB2' HG23 ' A' ' 60' ' ' VAL . 71.5 m-85 -82.31 132.57 35.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.165 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.61 -163.58 13.56 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -157.47 121.37 4.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.93 -171.39 0.16 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.475 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.16 98.14 2.21 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.23 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.448 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 38.8 t -108.1 142.36 38.41 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 3.4 m170 -60.28 -44.44 95.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 73' ' ' TYR . 45.0 mt -58.43 -35.18 71.7 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.184 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.505 ' O ' HG13 ' A' ' 25' ' ' ILE . 77.9 m -62.51 -49.99 73.17 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 175.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.65 -44.11 93.67 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.326 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.3 mm-40 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.684 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.413 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.1 mtp -69.09 -37.95 78.7 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.918 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 21' ' ' CYS . 71.5 mt -56.91 -48.92 80.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 175.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -59.53 -41.17 89.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.651 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.7 m -61.42 -46.7 89.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.899 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.486 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 93.2 mt -72.61 -31.31 65.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.381 -177.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -63.61 -39.02 93.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.921 0.391 . . . . 0.0 110.393 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.421 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 91.7 t -65.95 -44.9 92.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.31 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 31' ' ' LEU . 11.9 mt -62.73 -35.6 80.27 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.527 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.697 HE22 ' HB2' ' A' ' 39' ' ' LEU . 40.0 mt-30 -58.68 -21.38 54.27 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -74.69 -30.91 61.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.026 0.441 . . . . 0.0 110.738 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -91.17 -46.52 8.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.095 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.602 ' HB3' HD12 ' A' ' 84' ' ' LEU . 23.2 m -138.5 115.86 11.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.66 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -78.59 131.9 36.92 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.538 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.523 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 3.6 p90 -145.46 13.8 1.39 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.562 ' HB2' ' HD3' ' A' ' 9' ' ' LYS . 15.7 mt-10 57.64 179.86 0.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.516 -175.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HB2' HE22 ' A' ' 32' ' ' GLN . 8.3 tp -152.02 114.74 4.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' HG22 ' A' ' 11' ' ' VAL . 13.2 tt0 -129.64 120.34 25.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.309 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.3 116.86 45.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.954 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.419 HD12 HG11 ' A' ' 11' ' ' VAL . 68.5 mt -114.22 130.15 68.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -175.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -74.98 119.53 19.28 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.623 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.6 pt -88.12 -15.52 9.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.118 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -54.81 -37.26 65.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.372 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.94 -51.12 15.72 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.978 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -82.01 93.81 7.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.018 0.437 . . . . 0.0 110.739 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.91 -18.94 65.67 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.257 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.56 -43.42 98.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 171.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.71 -36.93 73.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.296 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.532 ' HA ' HD12 ' A' ' 44' ' ' ILE . 92.0 m -64.35 -34.85 79.1 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.582 176.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.3 -35.71 81.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.157 0.503 . . . . 0.0 109.866 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.61 -51.02 21.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.399 178.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -108.65 -64.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.888 -170.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 51' ' ' THR . 7.2 t30 55.37 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.349 0.66 . . . . 0.0 112.152 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -84.07 -29.27 26.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 -174.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HD2' ' N ' ' A' ' 57' ' ' ARG . 1.1 mpt_? -95.26 66.87 2.94 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.694 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -85.73 -122.71 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.632 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.751 179.059 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.694 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 88.3 Cg_exo -10.33 66.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.449 2.1 . . . . 0.0 113.409 -142.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.71 127.0 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.971 -167.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 10' ' ' LEU . 2.4 tm? -91.17 103.7 16.35 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.385 -177.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.492 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 79.2 t80 -95.57 136.89 35.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.754 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.54 109.3 20.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 21.4 t -85.72 153.69 3.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 2.6 m-20 71.71 22.09 4.1 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -173.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -157.44 -39.38 0.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.072 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 69.96 60.15 0.26 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.245 172.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.58 158.67 37.52 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.022 176.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -82.93 139.09 33.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.0 mt -105.23 -64.52 1.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.444 0.64 . . . . 0.0 110.09 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 71.0 m -132.14 -177.11 4.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.333 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.612 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 10.9 p80 -144.41 -170.32 3.34 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.784 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.3 p90 -39.67 134.05 1.4 Allowed 'General case' 0 C--O 1.238 0.492 0 O-C-N 124.081 0.863 . . . . 0.0 111.073 175.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.49 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 88.1 m-85 73.31 95.76 0.07 Allowed 'General case' 0 N--CA 1.464 0.229 0 O-C-N 124.474 1.109 . . . . 0.0 109.426 -171.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.5 tp -60.31 128.6 37.51 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.443 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -78.84 -32.71 46.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.1 m 69.98 -51.25 0.64 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.281 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -56.38 -48.04 77.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.986 0.422 . . . . 0.0 111.574 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 33.8 t -64.25 -51.67 65.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.369 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.97 -25.87 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.513 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.647 ' O ' ' O ' ' A' ' 85' ' ' SER . . . -64.35 -44.69 95.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.417 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.94 -24.49 65.19 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.241 0.544 . . . . 0.0 110.818 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -87.9 -57.05 3.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.163 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -71.94 -39.79 69.18 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.7 -170.506 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.647 ' O ' ' O ' ' A' ' 81' ' ' GLY . 32.6 t . . . . . 0 C--N 1.324 -0.524 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -174.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.565 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 11.7 pt-20 . . . . . 0 N--CA 1.451 -0.387 0 N-CA-C 110.141 -0.318 . . . . 72.51 110.141 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.1 Cg_endo -73.07 143.42 36.05 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.107 1.871 . . . . 72.33 111.839 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 1.001 ' NH1' ' O ' ' A' ' 85' ' ' SER . 10.8 ptp180 -97.73 171.39 8.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.761 -0.654 . . . . 65.23 109.751 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.573 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.4 tttt -135.79 152.78 51.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.048 0.452 . . . . 75.31 111.748 -174.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.642 HD13 HD11 ' A' ' 61' ' ' LEU . 95.4 mt -122.58 147.52 46.3 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.38 -0.827 . . . . 72.5 110.838 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' A' ' 64' ' ' VAL . 78.0 t -122.91 133.56 68.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.864 -0.607 . . . . 70.22 110.17 175.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 61' ' ' LEU . 72.6 t -105.37 114.32 44.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 120.941 0.4 . . . . 65.15 110.304 175.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.11 117.88 29.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.937 -0.574 . . . . 75.32 110.074 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.451 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.28 163.91 26.66 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.271 -0.966 . . . . 74.15 112.56 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.998 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.3 ptm180 -150.29 114.31 5.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.252 -0.277 . . . . 53.13 110.252 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.68 17.93 4.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.715 -0.675 . . . . 71.04 112.549 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.58 64.92 0.36 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.071 -0.585 . . . . 61.3 111.76 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 46.1 t -60.16 -47.68 84.91 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.437 0.295 . . . . 21.41 111.478 -175.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.565 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 t-160 -68.54 -47.25 67.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.519 -0.31 . . . . 71.11 110.546 -175.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -63.12 -36.08 82.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.323 -0.399 . . . . 70.31 111.001 -179.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.72 -47.8 82.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 63.3 110.14 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 27.5 mm-40 -56.88 -43.88 81.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.151 -0.477 . . . . 62.15 111.297 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.9 mm-40 -62.96 -48.18 79.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.882 -0.599 . . . . 74.33 110.989 -177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 81.3 mtp -67.46 -38.69 84.83 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.872 -0.331 . . . . 72.21 111.153 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 44.4 mt -57.46 -44.48 84.76 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.516 -0.179 . . . . 72.22 110.516 178.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.12 -43.34 82.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.891 0.377 . . . . 73.01 110.683 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -63.21 -43.33 98.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.051 177.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' MET . 92.7 mt -69.72 -34.36 73.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.932 -0.576 . . . . 74.12 111.112 -178.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 24.2 mmm-85 -60.67 -38.94 86.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.06 0.457 . . . . 74.45 110.576 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.585 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.1 t -70.13 -43.83 78.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.853 -0.612 . . . . 73.42 110.638 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -33.23 74.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.378 -0.374 . . . . 62.4 110.741 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -59.93 -23.92 63.92 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.746 0.308 . . . . 64.44 111.529 176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.1 mtmt -76.68 -17.69 58.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.103 0.478 . . . . 51.31 110.996 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -103.69 -43.14 5.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.699 -0.682 . . . . 72.2 110.423 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.563 ' HB3' HD12 ' A' ' 84' ' ' LEU . 20.0 m -142.94 119.88 11.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.217 -0.901 . . . . 43.42 109.452 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -78.22 131.77 37.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.345 . . . . 75.34 110.913 -177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.605 ' CD1' HD12 ' A' ' 10' ' ' LEU . 6.7 p90 -144.82 16.66 1.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.905 -0.588 . . . . 75.04 111.482 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 36.8 mm-40 58.58 -175.32 0.09 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 73.32 110.974 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.7 tp -151.58 110.71 3.9 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 122.001 -0.437 . . . . 62.32 110.692 172.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . 9.4 tp10 -104.62 141.16 36.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.043 -0.526 . . . . 74.04 109.912 176.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.4 t -127.89 117.29 45.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.454 -0.573 . . . . 71.01 109.454 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.4 mt -128.65 110.62 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.429 . . . . 60.45 111.657 -176.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.4 m120 -68.54 107.41 2.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.896 -0.593 . . . . 54.11 110.007 171.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.433 ' CD1' ' HB2' ' A' ' 54' ' ' TYR . 44.5 pt -82.79 -7.52 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.09 -0.505 . . . . 70.33 111.089 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -59.13 -35.62 73.79 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.429 0.456 . . . . 64.33 111.031 -174.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -82.22 -12.38 80.85 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.574 -0.822 . . . . 74.05 112.873 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -103.9 110.14 22.16 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.073 0.464 . . . . 75.11 110.323 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 15.3 tm-20 -59.08 -44.36 91.87 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.48 -0.782 . . . . 71.32 111.12 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -69.37 -34.96 75.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.578 -0.283 . . . . 73.03 111.442 -175.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.19 -34.71 66.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.88 0.372 . . . . 70.23 110.603 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.53 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 67.7 m -63.35 -31.19 72.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 73.35 110.702 178.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.0 mmm-85 -57.67 -35.8 71.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.368 0.604 . . . . 74.23 110.823 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.8 mt -89.54 -50.14 6.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.498 -0.773 . . . . 64.2 112.401 -175.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.562 ' O ' HG13 ' A' ' 58' ' ' VAL . 20.0 m-85 -108.82 3.97 23.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.332 0.864 . . . . 73.3 113.332 -165.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 51' ' ' THR . 10.4 t30 -43.2 -56.75 3.29 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.237 0.828 . . . . 71.32 113.237 -174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -98.18 1.46 47.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.002 0.371 . . . . 74.3 112.002 -173.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.449 ' O ' HG22 ' A' ' 60' ' ' VAL . 96.5 mtt180 -132.96 55.12 1.91 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 75.51 108.897 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.998 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -80.37 -135.07 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 118.825 -0.607 . . . . 74.24 111.978 -172.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.785 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 39.5 Cg_exo -5.45 68.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.476 0 C-N-CA 122.73 2.287 . . . . 64.13 113.474 -139.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -91.09 127.21 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 CA-C-N 115.649 -0.705 . . . . 64.13 110.104 -171.143 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 10' ' ' LEU . 2.7 tm? -93.0 107.3 19.11 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.675 -0.693 . . . . 72.02 109.577 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.502 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 83.6 t80 -98.71 138.22 36.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.077 -0.965 . . . . 65.51 111.305 -173.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.01 112.08 21.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.854 -0.612 . . . . 73.41 110.561 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.574 ' CG2' HG23 ' A' ' 11' ' ' VAL . 38.4 t -73.64 155.0 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.076 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 86.2 m-20 79.02 -49.0 0.43 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.913 0.885 . . . . 65.24 111.718 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -87.88 -20.45 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.734 0.302 . . . . 64.14 110.778 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.502 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 m-20 63.02 82.18 0.19 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.857 -0.611 . . . . 72.13 112.305 175.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? -167.17 139.91 3.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.641 -0.709 . . . . 64.13 110.19 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.34 126.2 30.56 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.153 -0.684 . . . . 72.45 109.153 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB3' HG12 ' A' ' 79' ' ' VAL . 83.6 mt -94.76 -79.21 0.43 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.397 0.618 . . . . 74.21 110.644 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 79' ' ' VAL . 67.3 m -107.78 177.28 4.87 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.358 -0.837 . . . . 71.52 110.281 -175.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 6.6 p80 -131.78 -170.84 2.47 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.298 -0.63 . . . . 74.0 109.298 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.462 ' HD2' ' HD2' ' A' ' 74' ' ' PHE . 34.4 p90 -44.54 132.65 6.12 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 123.737 0.648 . . . . 74.33 110.204 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.462 ' HD2' ' HD2' ' A' ' 73' ' ' TYR . 93.1 m-85 70.78 103.35 0.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 O-C-N 124.026 0.829 . . . . 72.24 109.673 -171.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.5 tp -53.77 121.71 8.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.157 -0.929 . . . . 63.32 111.789 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.414 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 16.4 m-20 -76.83 -22.78 53.09 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.993 -0.549 . . . . 72.3 110.264 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 71.27 -60.4 0.52 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.929 0.892 . . . . 73.52 112.923 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -57.33 -43.77 83.67 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.893 0.378 . . . . 63.31 111.427 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.484 ' HB ' ' SG ' ' A' ' 71' ' ' CYS . 83.5 t -66.61 -42.1 89.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.922 -0.581 . . . . 74.32 111.852 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -71.69 -36.25 58.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 120.085 -0.646 . . . . 64.23 110.244 177.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -58.9 -36.07 85.91 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.469 -0.872 . . . . 43.42 111.39 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.529 0.332 . . . . 50.14 111.265 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -88.08 -36.38 16.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.954 0.407 . . . . 74.23 111.306 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.732 HD23 HD11 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -81.52 14.31 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 72.13 111.914 -175.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 1.001 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 30.7 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.132 -0.485 . . . . 73.14 109.801 174.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 . . . . . 0 N--CA 1.448 -0.567 0 CA-C-O 120.766 0.317 . . . . 51.12 110.33 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.84 -179.77 5.07 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.925 2.417 . . . . 72.11 111.722 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HB3' ' OH ' ' A' ' 83' ' ' TYR . 25.9 mmt180 -97.07 -42.64 7.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.089 -0.505 . . . . 74.12 110.18 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.627 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.2 tmtp? 72.03 113.66 0.06 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.011 -0.995 . . . . 70.14 110.873 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.48 HD11 HD11 ' A' ' 80' ' ' ILE . 44.7 mt -106.86 131.56 53.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.509 -0.769 . . . . 73.12 111.014 177.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.4 t -106.79 130.2 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 75.41 109.68 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 61' ' ' LEU . 46.5 t -108.46 108.13 24.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 116.006 -0.543 . . . . 74.2 109.816 177.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.921 ' HB2' HG23 ' A' ' 60' ' ' VAL . 79.2 m-85 -76.22 118.25 18.75 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.965 -0.754 . . . . 72.41 108.965 175.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.87 -161.98 8.98 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.519 -0.848 . . . . 71.4 112.18 -176.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -162.65 -176.52 5.04 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.455 -0.572 . . . . 72.14 109.455 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.25 108.89 2.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.541 -0.3 . . . . 42.01 110.535 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 -144.93 16.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 121.087 -0.578 . . . . 73.22 112.067 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.8 m 70.69 95.76 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.056 0.542 . . . . 63.21 111.883 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.78 -39.59 81.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.633 -0.712 . . . . 72.31 109.897 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.545 HD23 ' OE2' ' A' ' 23' ' ' GLU . 64.6 mt -62.97 -30.94 71.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 73.31 111.794 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.89 -44.28 91.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 62.2 110.561 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -61.71 -43.01 99.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 60.05 110.279 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.545 ' OE2' HD23 ' A' ' 20' ' ' LEU . 39.0 mt-10 -66.0 -39.37 90.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.502 -0.772 . . . . 75.21 110.836 -178.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.422 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 11.6 mtt -61.25 -50.46 72.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 51.24 111.119 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.2 mt -57.21 -46.56 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.374 -0.376 . . . . 64.32 111.19 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.69 -32.58 73.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.914 0.388 . . . . 70.15 111.158 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -72.66 -45.52 58.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.765 -0.652 . . . . 54.44 110.875 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 24' ' ' MET . 96.9 mt -66.39 -32.37 73.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.927 -0.579 . . . . 64.13 111.233 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -56.73 -42.55 79.45 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.959 0.409 . . . . 70.53 110.91 176.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 61.4 t -67.14 -40.63 85.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.901 -0.591 . . . . 62.55 110.998 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.1 mt -70.06 -33.47 71.97 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.013 -0.275 . . . . 74.51 111.479 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.58 HE22 ' HB2' ' A' ' 39' ' ' LEU . 37.6 mt-30 -58.75 -21.15 54.73 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.853 0.359 . . . . 75.44 111.327 177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.5 mtmt -77.98 -15.48 58.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.423 . . . . 70.54 111.653 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.1 -43.91 4.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.542 0.687 . . . . 73.44 109.445 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.548 ' HB3' HD12 ' A' ' 84' ' ' LEU . 47.3 m -138.51 109.14 6.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.234 -0.894 . . . . 71.43 109.928 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -73.0 126.08 29.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.089 0.471 . . . . 74.33 110.963 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.627 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 4.7 p90 -136.04 18.75 3.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.022 -0.535 . . . . 72.53 111.368 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 59.92 175.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.532 0.682 . . . . 54.02 111.302 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.58 ' HB2' HE22 ' A' ' 32' ' ' GLN . 6.5 tp -151.26 109.79 3.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.009 -0.541 . . . . 74.12 110.606 173.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -121.22 117.79 27.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 54.24 109.868 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.55 115.26 48.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 109.764 -0.458 . . . . 75.45 109.764 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.2 mt -114.59 122.27 68.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.244 -0.435 . . . . 72.22 111.071 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.46 111.36 4.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.794 -0.639 . . . . 70.44 111.275 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.4 pt -81.0 -21.62 11.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.865 -0.421 . . . . 73.15 109.865 176.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -63.63 -18.95 64.47 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.901 -0.59 . . . . 74.34 111.476 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.87 9.14 59.94 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.691 -0.766 . . . . 52.42 112.253 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -133.09 113.11 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.743 0.306 . . . . 50.35 110.395 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 11.0 mm-40 -58.4 -42.6 87.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 62.32 111.248 -178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -60.5 -41.5 94.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.888 0.375 . . . . 74.31 110.678 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 53' ' ' LEU . 77.1 mt -77.23 -32.09 55.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 64.34 111.019 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.554 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 72.5 m -67.86 -25.63 65.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.316 0.579 . . . . 74.33 110.362 176.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.1 mmt-85 -78.44 -35.12 47.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 55.13 110.143 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.502 HD12 HD23 ' A' ' 50' ' ' LEU . 81.8 mt -70.76 -55.4 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 70.41 111.132 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -108.42 -67.68 0.96 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.006 -0.543 . . . . 70.32 112.065 -170.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 51' ' ' THR . 42.3 t-20 50.86 -87.38 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.984 0.803 . . . . 71.15 111.977 -170.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -89.38 21.86 3.16 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.398 0.618 . . . . 71.33 110.662 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -130.55 59.73 1.65 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.345 -0.843 . . . . 63.34 108.839 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.762 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -92.0 -127.1 0.0 OUTLIER Pre-proline 0 N--CA 1.431 -1.388 0 CA-C-O 117.823 -1.084 . . . . 74.33 109.735 -178.578 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.762 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 80.4 Cg_exo -12.96 71.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 122.504 2.136 . . . . 73.42 114.069 -143.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.921 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -102.11 118.97 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.323 -0.853 . . . . 73.15 111.456 -170.326 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 12' ' ' VAL . 50.8 mt -83.05 103.24 12.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.066 -0.515 . . . . 72.02 110.501 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -91.52 119.39 31.42 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.371 -0.831 . . . . 62.23 109.709 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.03 103.68 5.31 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.506 -0.77 . . . . 30.12 110.523 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.521 HG21 ' HD2' ' A' ' 9' ' ' LYS . 61.0 t -74.61 150.12 7.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 108.977 -0.749 . . . . 71.04 108.977 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.0 t30 67.04 21.94 10.09 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.839 0.828 . . . . 45.04 109.696 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.473 ' HG3' ' HE1' ' A' ' 83' ' ' TYR . 1.0 OUTLIER -152.56 -44.41 0.1 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.31 -0.859 . . . . 75.11 109.091 -178.587 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.7 t70 70.89 81.41 0.16 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.944 -1.025 . . . . 71.13 111.355 176.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -176.34 164.25 2.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.472 -0.786 . . . . 73.33 109.82 175.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -91.66 129.82 37.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.315 -0.402 . . . . 73.01 109.98 172.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.0 mt -84.29 -49.58 8.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.168 -0.678 . . . . 74.34 109.168 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 14.5 t -170.99 167.91 7.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.395 -0.965 . . . . 61.51 108.395 177.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 1.7 p-80 -143.96 147.2 33.6 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.152 -0.219 . . . . 65.32 111.204 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 71.0 m-85 74.97 -44.95 0.56 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 124.174 0.921 . . . . 74.23 111.967 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -125.21 163.74 21.81 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.339 -0.615 . . . . 71.23 109.339 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.7 tp -113.64 101.2 9.1 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.368 -0.378 . . . . 70.21 111.566 -168.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -80.98 93.01 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.738 -0.467 . . . . 64.54 109.738 172.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.506 ' HA ' HG22 ' A' ' 80' ' ' ILE . 14.1 m -56.25 -34.42 66.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.84 -0.618 . . . . 75.33 110.574 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -58.82 -40.59 84.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.545 -0.752 . . . . 73.41 111.134 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 91.2 t -76.8 -49.26 24.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.131 -0.486 . . . . 73.41 111.716 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.506 HG22 ' HA ' ' A' ' 77' ' ' SER . 7.2 tp -63.36 -35.24 71.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 120.737 -0.385 . . . . 65.43 110.694 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.25 -36.19 91.4 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.89 -0.671 . . . . 60.45 111.708 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.16 75.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 64.11 110.751 177.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.473 ' HE1' ' HG3' ' A' ' 66' ' ' GLU . 40.3 t80 -87.18 -50.09 6.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.837 -0.619 . . . . 65.12 111.839 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -63.58 -45.56 89.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.289 -0.414 . . . . 61.3 111.503 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 C--N 1.32 -0.715 0 CA-C-N 116.325 -0.398 . . . . 74.51 110.762 -177.371 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 44.3 mt-10 . . . . . 0 N--CA 1.444 -0.762 0 N-CA-C 109.477 -0.564 . . . . 73.33 109.477 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 88.3 Cg_endo -89.37 -170.75 0.47 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.285 2.657 . . . . 54.42 112.889 -172.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 22.7 mmt180 -103.99 164.87 11.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.634 -0.712 . . . . 62.25 109.576 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.617 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 2.1 tmtp? -141.23 129.52 22.32 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.7 -0.481 . . . . 72.44 109.7 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 ' CD1' ' A' ' 80' ' ' ILE . 57.9 mt -113.84 139.85 48.82 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.079 -0.51 . . . . 63.23 111.598 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.547 HG23 ' CG2' ' A' ' 64' ' ' VAL . 53.3 t -112.26 129.57 67.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.63 -0.714 . . . . 73.22 109.336 170.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.614 HG22 HD23 ' A' ' 61' ' ' LEU . 39.2 t -99.11 114.25 36.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.752 -0.462 . . . . 52.31 109.752 174.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -89.62 126.01 35.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.928 -0.578 . . . . 52.23 110.464 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.05 -163.34 12.93 Favored Glycine 0 N--CA 1.443 -0.862 0 C-N-CA 120.737 -0.744 . . . . 63.44 111.714 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.527 ' HD2' ' OD1' ' A' ' 45' ' ' ASP . 1.2 ptm180 -149.34 160.54 43.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.195 -0.298 . . . . 75.34 110.195 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -62.45 110.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.237 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.4 -19.6 4.53 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.531 -0.842 . . . . 51.21 112.463 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.7 m -74.39 85.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.894 0.378 . . . . 73.53 110.539 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 44.0 m80 -70.86 -30.82 67.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 73.2 110.354 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.59 HD12 ' HB2' ' A' ' 73' ' ' TYR . 2.3 tm? -60.31 -32.12 70.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.775 -0.648 . . . . 72.51 109.779 176.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.754 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 53.9 t -67.76 -38.7 83.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 63.14 110.265 176.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' HD12 ' A' ' 25' ' ' ILE . 50.6 mt-10 -68.0 -32.59 73.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.639 -0.71 . . . . 64.42 110.51 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 18.2 mm-40 -62.89 -39.33 94.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.933 -0.576 . . . . 73.43 110.079 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 78.6 mtp -69.33 -27.29 65.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.562 -0.744 . . . . 72.11 110.936 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 22' ' ' GLU . 74.0 mt -57.01 -43.41 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.462 -0.335 . . . . 72.34 110.17 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.46 97.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 72.23 110.665 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.9 m -60.18 -47.98 83.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.73 -0.668 . . . . 54.41 110.668 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 88.5 mt -62.37 -43.13 99.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.795 -0.639 . . . . 73.43 111.009 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HD2' ' OE1' ' A' ' 32' ' ' GLN . 14.8 mmm180 -55.48 -43.48 75.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 72.22 111.575 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.0 t -65.46 -40.96 89.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.495 -0.321 . . . . 74.54 110.685 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 31' ' ' LEU . 2.2 mt -66.76 -35.14 79.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.637 -0.256 . . . . 71.11 111.014 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.679 HE22 ' HB2' ' A' ' 39' ' ' LEU . 98.9 mt-30 -60.58 -21.38 62.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 63.01 111.503 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -78.05 -13.43 59.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.3 110.799 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -42.23 5.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.96 -0.563 . . . . 70.32 109.985 175.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 31.8 m -141.02 121.03 13.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.448 -0.796 . . . . 64.51 109.869 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -85.45 125.15 32.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.057 0.456 . . . . 74.12 111.199 -175.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.516 ' HB3' HD11 ' A' ' 84' ' ' LEU . 10.5 p90 -133.46 17.07 4.01 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.723 -0.671 . . . . 74.33 111.291 178.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.9 mt-10 58.67 -178.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.418 0.627 . . . . 74.12 111.313 -176.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.679 ' HB2' HE22 ' A' ' 32' ' ' GLN . 4.8 tp -151.25 109.93 3.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.033 -0.531 . . . . 64.15 110.456 173.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.617 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 3.2 tp10 -108.76 143.82 37.39 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.512 -0.551 . . . . 62.11 109.512 178.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.89 108.07 17.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.587 -0.523 . . . . 65.15 109.587 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.496 HD12 HG11 ' A' ' 11' ' ' VAL . 59.5 mt -118.78 118.45 57.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.082 0.468 . . . . 74.44 111.079 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -78.07 115.74 18.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.735 -0.666 . . . . 73.12 109.818 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.588 HG22 ' HB3' ' A' ' 50' ' ' LEU . 26.7 pt -71.74 -34.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.111 -0.495 . . . . 71.12 111.458 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -64.88 98.1 0.26 Allowed 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.37 0.605 . . . . 65.42 110.768 178.062 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 146.72 -37.79 1.17 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.053 -1.219 . . . . 74.01 110.053 -176.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 50' ' ' LEU . 45.6 t-20 -97.65 109.02 21.86 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.527 -0.916 . . . . 74.41 108.527 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -50.62 -34.96 28.17 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 123.878 0.736 . . . . 74.24 111.383 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.71 -49.97 19.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.396 -0.366 . . . . 64.44 110.756 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.588 ' HB3' HG22 ' A' ' 44' ' ' ILE . 32.9 mt -66.42 -34.45 77.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.795 -0.184 . . . . 74.43 111.36 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.1 m -57.78 -56.41 22.27 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.892 -0.323 . . . . 61.23 110.163 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 52' ' ' ARG . 35.0 mmt180 -63.78 -31.55 72.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.594 0.235 . . . . 73.52 111.54 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.0 mt -69.89 -47.15 63.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.4 0.518 . . . . 74.34 112.4 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.494 ' HB2' HG21 ' A' ' 44' ' ' ILE . 96.9 m-85 -117.4 -9.56 10.87 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.33 1.233 . . . . 73.55 114.33 -167.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -76.84 82.97 3.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 119.078 0.854 . . . . 74.32 109.658 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.56 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 16.2 t70 -154.34 -59.42 0.12 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.633 -1.167 . . . . 74.51 109.075 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.56 ' HG3' ' O ' ' A' ' 56' ' ' ASP . 46.7 mtm180 -157.91 90.33 1.06 Allowed 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.28 -1.748 . . . . 72.4 106.28 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.487 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.12 -107.06 0.0 OUTLIER Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 113.473 0.916 . . . . 71.54 113.473 -161.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.754 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 96.4 Cg_exo -9.62 72.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.695 0 C-N-CA 122.709 2.272 . . . . 75.33 113.873 -140.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -98.28 135.23 33.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.322 -0.854 . . . . 52.2 110.968 -168.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.614 HD23 HG22 ' A' ' 12' ' ' VAL . 34.9 mt -93.52 107.83 19.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 64.41 110.796 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -92.45 123.6 35.87 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.636 -0.711 . . . . 73.23 110.519 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.8 107.14 7.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.803 -0.635 . . . . 74.44 109.553 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.547 ' CG2' HG23 ' A' ' 11' ' ' VAL . 92.3 t -69.78 -31.33 48.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.924 0.392 . . . . 65.32 111.661 -174.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.401 ' HB2' HH11 ' A' ' 8' ' ' ARG . 12.1 m120 -81.85 -44.73 16.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.139 0.495 . . . . 75.44 110.67 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.715 ' HB2' ' HE1' ' A' ' 83' ' ' TYR . 3.5 tp10 -85.55 -20.94 28.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.11 111.138 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 62.23 74.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.664 -0.698 . . . . 75.23 110.56 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.43 ' HE3' ' CG ' ' A' ' 66' ' ' GLU . 19.6 ptpt -172.55 158.08 4.09 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.656 -0.702 . . . . 74.42 110.061 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -84.4 118.79 24.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.0 -0.371 . . . . 71.14 110.0 173.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 82.8 mt -88.01 -68.53 0.75 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.602 0.715 . . . . 65.51 110.788 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.566 ' HB2' HD12 ' A' ' 61' ' ' LEU . 85.6 m -119.21 170.74 8.82 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.697 -1.138 . . . . 64.13 110.41 -173.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -132.65 -172.23 2.86 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.704 -0.68 . . . . 74.01 109.645 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.688 ' HA ' ' SD ' ' A' ' 24' ' ' MET . 21.6 p90 -52.45 138.31 27.7 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.71 -0.478 . . . . 73.35 109.71 175.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 82.4 m-85 70.67 98.59 0.06 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.957 0.786 . . . . 75.23 108.978 -167.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 tp -52.39 119.93 4.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.684 -1.144 . . . . 61.42 112.454 -170.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.525 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 4.7 m-20 -66.21 -31.46 72.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.919 -0.582 . . . . 74.34 109.712 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.2 m 72.91 -54.63 0.69 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.118 -0.946 . . . . 73.4 112.834 172.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -74.63 -48.75 24.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.524 0.202 . . . . 72.44 111.504 -175.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 15.4 t -56.32 -49.35 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 112.412 0.523 . . . . 65.2 112.412 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.68 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -64.6 -30.93 51.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 C-N-CA 120.302 -0.559 . . . . 72.34 110.507 177.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.82 -37.04 93.66 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.83 -0.7 . . . . 73.55 112.021 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.68 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.39 0.614 . . . . 33.44 111.019 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.715 ' HE1' ' HB2' ' A' ' 66' ' ' GLU . 81.3 t80 -84.35 -36.18 22.69 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 61.31 110.798 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.68 HD23 HD11 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -87.84 13.54 10.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.807 -0.633 . . . . 74.5 111.759 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.443 -0.344 . . . . 74.12 110.129 175.861 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.535 -0.172 . . . . 72.33 110.535 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -80.96 166.54 18.87 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.467 2.112 . . . . 74.55 112.544 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 3.8 mpt_? -95.22 171.68 8.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.968 -0.56 . . . . 72.02 109.882 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 45.8 mtpt -126.56 146.99 49.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.834 0.35 . . . . 65.54 110.829 175.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 80' ' ' ILE . 84.1 mt -120.42 128.24 53.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.814 -0.63 . . . . 75.22 110.1 174.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.534 HG22 ' HB3' ' A' ' 40' ' ' GLU . 55.4 t -108.5 127.41 64.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.896 -0.593 . . . . 55.12 110.305 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.689 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -98.94 108.2 21.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.772 -0.649 . . . . 74.43 109.276 174.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 1.018 ' HB2' HG23 ' A' ' 60' ' ' VAL . 19.0 m-85 -77.93 107.76 10.69 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.576 -0.45 . . . . 54.51 109.886 176.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -130.72 -145.51 5.71 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.946 -0.861 . . . . 32.42 110.946 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' HD11 ' A' ' 44' ' ' ILE . 6.7 ptm180 -174.78 110.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.878 0.339 . . . . 75.41 111.241 177.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 65.06 -87.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.663 -0.699 . . . . 75.32 111.727 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.46 134.52 5.21 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 121.03 -0.605 . . . . 74.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.574 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 44.1 t -153.29 141.29 20.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.918 -0.401 . . . . 74.43 109.918 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -60.22 -34.64 73.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 72.04 110.922 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.569 ' HG ' ' HD1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -73.72 -32.95 64.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.535 . . . . 71.11 111.243 -177.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.574 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 70.7 m -64.28 -42.19 96.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.472 -0.331 . . . . 70.1 110.455 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -54.4 -38.25 65.98 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.222 0.534 . . . . 71.14 110.437 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -74.75 -48.38 25.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.665 -0.698 . . . . 71.23 111.345 -176.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 87.3 mtp -67.13 -42.95 83.57 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.112 -0.235 . . . . 73.01 111.282 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.52 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 71.8 mt -58.74 -48.28 86.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.401 0.143 . . . . 64.13 110.926 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.952 0.406 . . . . 63.22 110.892 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 m -62.91 -43.89 97.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.795 -0.639 . . . . 64.53 111.074 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 92.9 mt -69.03 -35.25 76.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.31 -0.404 . . . . 64.12 111.373 -178.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm180 -57.77 -40.95 80.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.858 0.361 . . . . 62.0 110.864 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.46 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 78.5 t -67.31 -40.12 84.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 62.41 110.867 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.33 -32.06 72.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.69 -0.232 . . . . 72.42 111.23 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 95.3 mt-30 -57.65 -23.01 48.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 72.33 111.339 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -76.58 -19.18 58.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.143 -0.481 . . . . 71.31 111.177 -177.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -105.46 -40.25 5.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.124 0.488 . . . . 70.45 110.545 176.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.575 ' HB3' HD12 ' A' ' 84' ' ' LEU . 19.6 m -140.92 120.38 13.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.915 -0.584 . . . . 61.31 109.756 -178.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.7 t-105 -83.81 123.98 30.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.116 0.484 . . . . 71.14 111.159 -176.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 5.6 p90 -134.88 19.07 3.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.487 -0.779 . . . . 73.23 110.519 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 18.7 mm-40 59.01 -178.23 0.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.923 -0.58 . . . . 75.12 110.302 -176.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.483 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.6 tp -151.95 108.71 3.49 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.619 -0.512 . . . . 71.43 109.619 170.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.534 ' HB3' HG22 ' A' ' 11' ' ' VAL . 19.4 tt0 -120.28 117.9 29.03 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.569 -0.741 . . . . 71.15 109.473 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.06 108.6 25.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 73.54 109.534 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 70.3 mt -110.12 118.01 56.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.92 -0.582 . . . . 60.15 110.001 -177.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 87.4 m-20 -70.19 138.08 51.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.953 -0.567 . . . . 70.13 110.51 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.8 pt -65.89 -25.74 36.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.524 -0.917 . . . . 63.15 108.524 169.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 43' ' ' ASN . 10.6 t70 -57.11 112.01 1.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.589 -1.187 . . . . 63.01 109.548 170.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 120.42 -25.91 7.17 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.049 -0.82 . . . . 62.02 111.049 -174.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.411 HD22 HD12 ' A' ' 50' ' ' LEU . 92.0 m-20 -118.57 106.86 13.07 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.595 -0.52 . . . . 71.21 109.595 175.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.48 -33.79 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.216 -0.447 . . . . 74.32 111.176 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -69.17 -35.57 76.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.453 -0.339 . . . . 74.24 110.516 -176.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.497 ' HB3' HG22 ' A' ' 44' ' ' ILE . 71.5 mt -73.36 -44.28 59.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 71.04 110.887 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.573 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 38.4 m -65.97 -25.24 67.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.037 0.446 . . . . 63.42 110.921 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -38.54 89.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.321 0.581 . . . . 61.12 110.099 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 75.8 mt -90.43 -52.89 4.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.383 -0.826 . . . . 73.1 111.463 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 57' ' ' ARG . 18.9 m-85 -102.74 21.0 16.23 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.758 0.651 . . . . 64.34 112.758 -167.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.573 ' HB2' ' O ' ' A' ' 51' ' ' THR . 9.9 t30 -50.81 -44.24 59.03 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.774 0.321 . . . . 75.21 111.191 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -124.27 24.96 7.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.218 1.009 . . . . 71.31 109.271 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.697 ' HB2' ' HA ' ' A' ' 54' ' ' TYR . 5.0 mmp_? -136.32 36.97 2.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.419 -0.956 . . . . 72.33 108.419 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.6 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -83.16 -108.09 0.0 OUTLIER Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.37 -0.824 . . . . 50.13 110.56 -173.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.6 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 31.0 Cg_exo -15.01 68.01 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.481 0 C-N-CA 122.622 2.214 . . . . 74.54 114.124 -144.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 1.018 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -98.99 115.78 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 114.933 -1.03 . . . . 44.43 110.497 -172.323 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.689 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -86.64 105.13 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.584 -0.734 . . . . 72.23 109.528 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -92.28 129.46 38.22 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.959 -1.019 . . . . 75.35 110.58 -176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -84.79 105.74 15.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.521 -0.763 . . . . 73.13 110.683 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.467 HG21 HG23 ' A' ' 11' ' ' VAL . 24.9 t -79.35 84.09 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 65.14 110.586 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.41 ' HB2' ' OH ' ' A' ' 83' ' ' TYR . 0.0 OUTLIER 176.23 -54.46 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.992 -1.004 . . . . 45.43 109.248 178.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -98.0 -12.82 21.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.067 -0.969 . . . . 72.13 111.007 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 61.8 78.1 0.3 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.89 -0.595 . . . . 70.25 109.799 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.58 163.92 6.72 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.515 -0.766 . . . . 64.24 110.213 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -84.58 142.95 29.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.341 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.6 mt -99.88 -32.71 10.86 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.506 -0.553 . . . . 71.21 109.506 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.8 t -173.7 151.74 1.92 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.176 -0.92 . . . . 72.32 109.244 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.66 ' HB3' HG12 ' A' ' 60' ' ' VAL . 2.6 p-80 -135.24 129.96 34.47 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.716 -0.476 . . . . 75.32 109.716 173.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.569 ' HD1' ' HG ' ' A' ' 20' ' ' LEU . 96.8 m-85 66.71 122.15 0.02 OUTLIER 'General case' 0 C--O 1.235 0.341 0 O-C-N 124.239 0.962 . . . . 75.25 110.728 -170.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.47 ' H ' ' CD1' ' A' ' 20' ' ' LEU . 84.5 m-85 65.67 -160.85 0.27 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.077 -1.419 . . . . 74.13 109.603 -176.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.5 tp -136.98 117.34 13.64 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 120.088 -0.645 . . . . 71.45 111.761 -172.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -86.86 87.65 7.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.135 -0.484 . . . . 65.11 109.741 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 m -59.33 -32.3 69.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.809 -0.632 . . . . 74.23 110.753 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -59.16 -43.39 92.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.837 -0.62 . . . . 72.43 111.169 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.4 t -75.33 -46.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 72.53 111.562 -176.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.847 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.99 -30.91 48.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.257 -0.577 . . . . 72.15 110.323 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.23 -29.52 75.51 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.561 -0.828 . . . . 63.33 111.524 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.98 -26.54 36.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.089 0.471 . . . . 73.41 110.508 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.41 ' OH ' ' HB2' ' A' ' 65' ' ' ASN . 63.9 t80 -87.46 -52.55 5.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 73.21 112.157 -177.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.847 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.231 -0.44 . . . . 63.43 111.461 -170.169 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 75.32 110.188 177.04 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 . . . . . 0 N--CA 1.448 -0.526 0 N-CA-C 109.682 -0.488 . . . . 75.41 109.682 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.8 122.81 5.55 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.401 2.067 . . . . 74.32 111.569 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -110.35 105.08 13.96 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 71.15 110.318 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 1.9 tmtp? -71.47 146.33 48.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.063 -0.971 . . . . 74.04 110.247 -173.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.653 HD12 ' CD1' ' A' ' 37' ' ' PHE . 98.5 mt -124.48 136.85 54.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.073 0.464 . . . . 62.25 111.347 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.717 HG23 HG21 ' A' ' 64' ' ' VAL . 39.3 t -114.48 135.72 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.89 -0.595 . . . . 72.03 110.17 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.667 HG22 HD23 ' A' ' 61' ' ' LEU . 98.5 t -107.54 106.84 21.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.565 -0.531 . . . . 74.42 109.565 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.862 ' HB2' HG23 ' A' ' 60' ' ' VAL . 89.7 m-85 -76.99 122.98 25.67 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.764 -0.828 . . . . 74.22 108.764 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -157.51 -169.26 21.06 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 119.503 -1.332 . . . . 62.41 112.922 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.828 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.3 ptm180 -154.6 144.58 21.77 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.848 -0.797 . . . . 73.22 108.848 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -75.83 87.92 2.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.046 0.451 . . . . 75.33 110.037 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.08 32.1 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.551 -0.749 . . . . 51.12 111.511 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 p -170.58 138.99 1.53 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.69 -0.485 . . . . 74.31 109.69 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -70.68 -29.89 66.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 54.55 112.127 -172.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.422 HD12 ' CD1' ' A' ' 73' ' ' TYR . 26.4 mt -55.78 -30.4 61.23 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.489 0.551 . . . . 72.12 112.489 -175.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' HG13 ' A' ' 25' ' ' ILE . 76.1 m -54.5 -50.5 67.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.327 . . . . 63.21 110.863 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.75 -35.59 81.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.115 -0.493 . . . . 61.12 110.834 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -68.76 -44.1 74.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.669 -0.696 . . . . 71.53 111.309 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.6 mtp -65.65 -37.53 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.925 -0.31 . . . . 75.31 111.157 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.0 mt -57.71 -52.38 58.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 110.143 -0.317 . . . . 63.11 110.143 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.44 89.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 60.13 110.879 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.8 m -59.15 -42.87 91.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.92 -0.582 . . . . 71.33 111.106 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.2 mt -68.45 -42.53 78.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 71.23 111.046 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -60.84 -26.44 67.35 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.97 0.359 . . . . 74.11 111.97 -175.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.79 -44.83 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.654 0.264 . . . . 75.52 110.602 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.87 -26.01 53.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.343 0.592 . . . . 74.13 109.82 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -60.98 -20.54 62.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.4 -0.818 . . . . 72.12 110.366 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -71.95 -16.83 62.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.828 -0.624 . . . . 75.04 111.514 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.35 -39.02 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.49 -0.323 . . . . 70.25 111.153 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.412 ' HB3' HD12 ' A' ' 84' ' ' LEU . 18.2 m -126.97 135.98 51.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.505 -0.316 . . . . 64.0 111.056 -174.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -84.13 110.93 18.88 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.224 -0.443 . . . . 72.34 110.478 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.896 ' HB3' HD11 ' A' ' 84' ' ' LEU . 32.4 p90 -132.57 6.18 4.06 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.93 -0.577 . . . . 72.04 110.744 176.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.582 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.8 mt-10 59.77 -177.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.675 . . . . 64.32 111.546 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -149.19 120.02 7.59 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.994 -0.548 . . . . 63.05 110.017 175.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.694 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 23.3 tt0 -131.29 118.03 19.78 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.822 -0.436 . . . . 62.42 109.822 177.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -103.9 114.24 42.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 109.543 -0.54 . . . . 63.23 109.543 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 HG11 ' A' ' 11' ' ' VAL . 62.6 mt -112.62 116.89 53.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.256 0.55 . . . . 74.43 111.04 -176.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -71.75 107.45 4.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 62.5 110.582 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 29.7 pt -76.34 -10.73 13.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.286 0.565 . . . . 75.34 109.62 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -46.81 -39.2 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.421 -1.263 . . . . 74.24 112.651 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.5 20.99 48.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.526 -0.845 . . . . 75.25 112.9 -176.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.488 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 15.6 t-20 -137.26 110.36 7.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.882 0.341 . . . . 71.5 110.564 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -59.02 -33.78 71.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.334 -0.394 . . . . 63.35 111.807 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 66.2 m170 -66.21 -52.19 50.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 73.45 110.404 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.35 -38.97 88.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.87 -0.604 . . . . 73.43 110.958 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.632 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 94.9 m -62.05 -40.97 97.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.872 0.367 . . . . 74.44 111.243 177.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 70.1 mtp85 -75.53 -31.98 60.3 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 122.077 -0.39 . . . . 63.13 110.576 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -64.12 -51.43 64.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 53.34 110.978 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -109.61 -72.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.067 -0.515 . . . . 72.02 111.596 -173.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.632 ' HB2' ' O ' ' A' ' 51' ' ' THR . 39.8 t-20 51.02 -81.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.691 0.797 . . . . 64.21 111.725 -169.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -91.23 8.6 35.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.686 0.755 . . . . 71.22 110.104 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.11 46.89 1.1 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.203 -0.666 . . . . 72.41 109.203 169.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.828 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -81.86 -142.24 0.0 OUTLIER Pre-proline 0 N--CA 1.447 -0.6 0 CA-C-O 118.578 -0.725 . . . . 72.25 110.653 -178.781 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.815 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 82.7 Cg_exo -8.01 71.38 0.0 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.885 0 C-N-CA 122.663 2.242 . . . . 51.52 113.885 -139.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.862 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.77 113.48 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.453 -0.794 . . . . 53.35 110.136 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.667 HD23 HG22 ' A' ' 12' ' ' VAL . 2.5 tm? -83.37 106.75 15.38 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.765 -0.652 . . . . 64.35 109.355 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -100.57 134.4 43.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.82 -1.082 . . . . 75.44 110.797 -175.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.57 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -84.91 106.19 16.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.841 -0.618 . . . . 75.41 110.943 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.717 HG21 HG23 ' A' ' 11' ' ' VAL . 49.1 t -86.31 91.93 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.937 0.399 . . . . 72.11 111.067 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 40.7 t-20 168.97 -57.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.666 -1.152 . . . . 42.13 108.21 176.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -91.21 -18.87 23.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.549 -0.75 . . . . 73.24 110.499 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.1 t70 68.05 87.02 0.13 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.689 -0.687 . . . . 71.24 110.002 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -167.37 165.53 14.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.312 -0.858 . . . . 75.1 109.467 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -108.99 137.8 46.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.892 -0.41 . . . . 74.03 109.892 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 61' ' ' LEU . 18.9 mt -96.79 -70.47 0.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.017 0.437 . . . . 74.0 110.869 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 21.4 p -143.91 160.63 40.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 51.44 110.189 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.54 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.8 p-80 -139.54 144.47 37.88 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.159 -0.216 . . . . 71.03 110.999 179.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 6.6 m-85 74.54 -43.79 0.54 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.831 0.852 . . . . 72.44 112.81 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -135.56 137.0 41.59 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.202 -0.666 . . . . 72.01 109.202 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 17.8 tp -89.71 110.71 21.58 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.049 0.452 . . . . 60.31 110.525 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -64.97 -28.41 69.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.805 -0.634 . . . . 61.02 111.087 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.0 m 75.77 -40.99 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.804 -0.635 . . . . 72.31 112.143 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -76.6 -45.97 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.071 -0.393 . . . . 62.21 110.455 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.3 t -55.31 -49.83 69.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.171 -0.468 . . . . 72.24 111.68 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.525 HD11 HD11 ' A' ' 10' ' ' LEU . 7.2 tp -66.83 -34.75 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 64.32 110.397 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.24 -22.84 77.57 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.879 -0.677 . . . . 63.52 111.972 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.16 -32.76 56.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.166 0.507 . . . . 72.22 110.173 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.441 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 85.2 t80 -87.09 -38.97 16.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.637 -0.71 . . . . 61.01 111.804 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.896 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -79.17 4.02 16.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.637 0.606 . . . . 74.41 112.637 -171.453 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.606 -0.516 . . . . 71.35 109.606 173.293 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 1.2 mm-40 . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 108.609 -0.886 . . . . 70.21 108.609 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB3' ' HD1' ' A' ' 36' ' ' TRP . 87.3 Cg_endo -76.66 158.93 35.57 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.02 1.814 . . . . 64.11 111.827 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.696 ' NH2' ' O ' ' A' ' 85' ' ' SER . 44.9 mtt180 -81.21 -21.64 39.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.418 -0.356 . . . . 70.04 111.436 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 3.9 tmtp? 64.34 108.52 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.933 0.771 . . . . 62.43 112.828 170.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 80' ' ' ILE . 32.0 mt -105.43 133.01 50.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.618 -0.719 . . . . 52.21 110.811 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.6 t -109.85 131.69 60.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.687 -0.688 . . . . 64.52 109.84 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.52 HG22 ' CD2' ' A' ' 61' ' ' LEU . 62.3 t -99.31 109.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.829 -0.434 . . . . 71.34 109.829 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.956 ' HB2' HG23 ' A' ' 60' ' ' VAL . 12.9 m-85 -84.33 120.33 26.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.138 -0.483 . . . . 71.52 110.124 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.485 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -138.87 170.5 23.99 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.157 -0.777 . . . . 63.02 111.157 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.413 ' HG2' HG21 ' A' ' 58' ' ' VAL . 12.2 ptm180 -135.72 123.66 22.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.12 0.46 . . . . 75.23 110.813 178.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 61.27 -81.53 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.262 0.976 . . . . 60.32 112.454 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.82 139.36 6.01 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.673 -0.775 . . . . 44.12 112.203 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.2 m -148.84 115.71 6.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.1 -0.333 . . . . 73.02 110.1 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -56.48 -46.84 80.25 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.983 0.421 . . . . 63.11 111.098 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.568 HD11 ' H ' ' A' ' 74' ' ' PHE . 1.9 tm? -63.98 -32.15 73.59 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.767 -0.651 . . . . 63.12 110.707 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.581 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 42.1 t -67.33 -38.68 85.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.535 -0.302 . . . . 62.23 110.557 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.21 -39.92 73.24 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.493 0.663 . . . . 75.4 110.22 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -69.89 -34.18 73.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.085 -0.961 . . . . 54.22 110.843 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.494 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 73.3 mtp -68.0 -42.18 81.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 43.43 109.982 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 79.7 mt -55.83 -46.12 79.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.748 -0.66 . . . . 55.12 110.728 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.01 98.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.509 . . . . 73.34 110.91 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 m -60.52 -39.09 86.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.291 0.567 . . . . 73.51 110.717 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.537 HD11 HD21 ' A' ' 61' ' ' LEU . 84.3 mt -71.24 -33.8 70.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.999 -0.546 . . . . 63.3 111.684 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.14 -40.73 96.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.362 . . . . 72.42 110.213 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 63.0 t -66.76 -43.65 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.22 110.858 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.457 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.0 mt -63.03 -33.66 75.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.69 -0.232 . . . . 70.33 111.27 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.828 HE22 ' HB2' ' A' ' 39' ' ' LEU . 47.5 mt-30 -58.94 -25.27 63.35 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.876 0.324 . . . . 63.23 111.876 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -75.37 -19.39 59.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.077 0.465 . . . . 74.54 110.734 -179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -101.33 -44.68 5.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 72.34 109.689 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 13.5 m -139.22 120.35 14.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 64.23 109.582 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.434 ' HD1' ' HB3' ' A' ' 7' ' ' PRO . 56.5 t-105 -83.61 124.01 30.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.391 0.615 . . . . 64.51 111.226 -174.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.53 ' CD1' HD12 ' A' ' 10' ' ' LEU . 4.4 p90 -135.45 13.95 3.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.864 -0.607 . . . . 75.41 111.369 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 17.0 mm-40 60.44 174.45 0.1 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.465 0.65 . . . . 72.21 111.584 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.828 ' HB2' HE22 ' A' ' 32' ' ' GLN . 9.1 tp -151.32 112.76 4.38 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.133 -0.485 . . . . 61.22 110.726 173.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.63 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 28.1 tt0 -124.77 118.76 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -99.94 120.52 49.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.865 -0.421 . . . . 73.23 109.865 -177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 71.2 mt -125.82 121.13 59.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.941 0.401 . . . . 73.12 111.178 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 9.3 m120 -66.62 125.7 26.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.742 -0.663 . . . . 72.54 111.162 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.44 HG22 HD13 ' A' ' 50' ' ' LEU . 22.3 pt -88.12 -23.24 6.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.459 -0.337 . . . . 74.0 110.268 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -59.92 117.18 4.73 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.383 0.611 . . . . 64.43 110.429 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.24 -31.02 6.95 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.482 -0.781 . . . . 31.34 111.465 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -92.79 113.34 25.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.233 -0.654 . . . . 73.02 109.233 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -38.13 89.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.696 -0.229 . . . . 64.1 111.553 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -60.6 -51.51 69.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.28 0.562 . . . . 74.04 110.4 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 44' ' ' ILE . 92.6 mt -67.58 -37.56 82.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.668 -0.697 . . . . 63.44 111.253 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.676 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 63.8 m -66.57 -43.46 84.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 75.54 110.842 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -67.28 -37.39 83.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.819 0.342 . . . . 75.4 110.293 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.2 -55.92 13.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.047 -0.524 . . . . 63.21 111.46 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.86 -66.07 0.97 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.394 -0.366 . . . . 71.5 111.529 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.676 ' HB2' ' O ' ' A' ' 51' ' ' THR . 58.7 t30 51.92 -83.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.111 0.782 . . . . 72.44 113.111 -175.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -85.44 -16.41 39.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.983 -0.553 . . . . 72.0 111.676 -170.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.62 78.0 1.48 Allowed 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.347 -1.353 . . . . 64.35 107.347 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.55 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.28 -97.54 0.0 OUTLIER Pre-proline 0 N--CA 1.423 -1.794 0 CA-C-O 118.163 -0.922 . . . . 70.23 110.676 -175.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.581 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 85.3 Cg_exo -21.29 75.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.821 2.347 . . . . 75.25 114.154 -149.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.956 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -107.23 122.89 62.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.267 -0.879 . . . . 71.51 110.798 -170.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 28' ' ' LEU . 48.1 mt -85.01 109.56 18.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.084 0.469 . . . . 72.42 110.769 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 88.1 t80 -92.46 124.11 36.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.448 -0.796 . . . . 74.31 110.691 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.83 109.17 16.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.744 . . . . 70.15 109.719 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.614 HG21 ' HD2' ' A' ' 9' ' ' LYS . 57.8 t -73.21 -20.53 18.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.289 -0.414 . . . . 43.41 111.794 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -51.78 18.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.951 0.352 . . . . 64.42 111.951 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -100.95 -5.19 26.27 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.823 0.344 . . . . 72.21 111.464 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 63.61 78.87 0.27 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.495 0.664 . . . . 65.25 111.344 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.465 ' NZ ' ' HB2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -176.98 177.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.111 -0.95 . . . . 73.12 108.82 175.175 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.52 156.38 17.32 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 120.905 0.383 . . . . 72.32 110.694 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.414 ' HB3' HG12 ' A' ' 79' ' ' VAL . 66.1 mt -111.1 -76.32 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.621 0.724 . . . . 74.04 110.403 177.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 41.5 t -115.7 142.92 46.1 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.574 -1.194 . . . . 64.34 109.737 -175.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 17.7 p-80 -133.13 130.05 38.72 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.302 -0.408 . . . . 73.44 110.481 177.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.404 ' CZ ' ' HD2' ' A' ' 59' ' ' PRO . 71.4 m-85 68.7 140.02 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.099 -0.955 . . . . 74.42 112.348 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.568 ' H ' HD11 ' A' ' 20' ' ' LEU . 98.8 m-85 58.1 -105.77 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.205 -1.361 . . . . 63.34 111.352 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 12.0 tp 172.36 107.46 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 123.764 0.665 . . . . 74.04 109.537 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -71.73 -25.68 62.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 74.3 109.966 176.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.0 m 69.08 -55.03 0.56 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.116 -0.947 . . . . 65.14 112.189 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.12 -43.7 91.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.689 0.28 . . . . 71.11 111.733 -177.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 70' ' ' LEU . 84.1 t -64.12 -46.28 94.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.476 -0.329 . . . . 64.43 111.74 -177.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 10' ' ' LEU . 6.0 tp -70.51 -33.86 55.2 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 119.989 -0.685 . . . . 41.4 109.79 176.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.63 99.69 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.797 -0.716 . . . . 54.3 111.587 176.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.95 -32.02 71.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 63.25 110.907 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.834 -0.621 . . . . 74.12 111.065 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.7 OUTLIER -92.04 13.56 18.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 70.01 111.926 -176.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.696 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 67.7 m . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 110.028 -0.36 . . . . 65.14 110.028 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.485 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 13.4 pt-20 . . . . . 0 N--CA 1.449 -0.48 0 N-CA-C 109.439 -0.578 . . . . 72.44 109.439 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.485 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 61.2 Cg_endo -70.44 162.92 40.67 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.118 1.879 . . . . 63.3 111.461 177.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -101.52 173.27 6.51 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.366 -0.379 . . . . 75.23 110.482 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.536 ' HG2' ' HB2' ' A' ' 38' ' ' GLU . 19.8 mtpt -135.05 126.6 28.78 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.975 -0.557 . . . . 74.41 109.946 174.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.405 HD11 HD11 ' A' ' 80' ' ' ILE . 37.0 mt -108.45 120.79 43.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.868 -0.605 . . . . 75.25 110.305 173.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 40' ' ' GLU . 79.6 t -102.11 126.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.726 -0.67 . . . . 73.43 109.573 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.558 HG22 HD23 ' A' ' 61' ' ' LEU . 59.2 t -96.55 105.98 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 109.193 -0.669 . . . . 64.33 109.193 175.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.581 ' O ' HG23 ' A' ' 60' ' ' VAL . 35.6 m-85 -82.95 105.15 13.71 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.26 -0.644 . . . . 74.21 109.26 174.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.57 -168.15 12.65 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.568 -0.825 . . . . 60.33 111.488 -177.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.876 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.1 ptm180 -169.76 -159.03 0.2 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.882 -0.784 . . . . 74.42 108.882 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.98 109.04 0.28 Allowed 'General case' 0 C--N 1.318 -0.793 0 O-C-N 124.185 0.928 . . . . 73.21 109.271 171.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -155.31 -170.69 21.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.299 -0.953 . . . . 45.0 112.8 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.02 -155.09 0.59 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.562 0.22 . . . . 73.42 110.424 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.9 p-80 -52.92 -33.23 49.69 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.988 1.107 . . . . 71.54 113.988 -170.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 20' ' ' LEU . 16.8 mt -56.62 -34.75 67.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.602 0.637 . . . . 62.41 112.025 -176.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 37.0 t -63.62 -43.9 95.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.425 -178.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -85.24 -21.29 29.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.52 -0.309 . . . . 73.51 111.29 -177.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.7 mt-10 -66.19 -44.74 83.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.864 0.364 . . . . 72.14 110.121 175.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.555 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.9 mtp -62.77 -40.58 97.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.001 -0.545 . . . . 75.43 110.28 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.564 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.6 mt -58.35 -49.85 80.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 54.4 110.562 176.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.48 94.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.362 -0.381 . . . . 63.23 111.194 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -61.3 -43.38 98.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.032 -0.531 . . . . 73.52 110.579 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.624 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 83.1 mt -66.04 -30.8 71.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 75.01 111.2 -179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 14.3 mmm180 -63.16 -38.67 92.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.95 0.405 . . . . 72.44 110.411 177.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.9 t -73.4 -40.54 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 73.34 110.617 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 31' ' ' LEU . 6.8 mt -64.81 -31.79 73.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 74.1 111.142 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -58.23 -24.85 60.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.719 0.295 . . . . 52.32 111.701 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -70.22 -28.97 65.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 74.54 110.537 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -93.71 -44.8 7.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 70.51 110.462 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.4 m -143.17 117.86 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.673 -0.694 . . . . 71.04 110.142 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.9 t-105 -78.13 128.92 34.53 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.11 0.481 . . . . 62.11 110.834 -178.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.624 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 2.6 p90 -141.72 20.18 2.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 70.21 110.82 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.536 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 63.5 mm-40 59.28 -178.2 0.09 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.147 0.499 . . . . 72.51 110.849 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.555 HD21 HG23 ' A' ' 25' ' ' ILE . 4.5 tp -151.6 109.9 3.76 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.686 -0.405 . . . . 71.24 110.718 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.515 ' HB3' HG22 ' A' ' 11' ' ' VAL . 24.1 tt0 -124.15 117.65 25.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.842 -0.617 . . . . 75.11 109.426 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.57 124.07 68.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.134 -0.484 . . . . 75.15 109.866 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.0 mt -128.9 117.75 45.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.419 -0.355 . . . . 71.53 111.176 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -67.69 114.47 6.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.998 -0.546 . . . . 51.33 111.047 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.6 pt -83.38 -8.85 11.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.452 -0.34 . . . . 65.03 110.62 177.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 15' ' ' ARG . 5.6 p-10 -74.97 -17.13 60.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 74.14 110.581 178.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.31 -8.58 59.87 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.942 -0.646 . . . . 53.54 111.954 177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -125.71 101.08 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.966 -0.383 . . . . 65.34 109.966 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 1.6 mp0 -54.43 -33.87 60.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.898 -0.592 . . . . 64.13 112.017 -174.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -66.57 -37.53 85.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 72.52 110.263 -177.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 53' ' ' LEU . 74.8 mt -74.9 -24.41 58.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.373 -0.376 . . . . 54.33 110.284 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 4.8 m -64.99 -33.68 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.407 0.622 . . . . 63.15 109.62 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 mmt85 -77.37 -32.51 55.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.864 -0.607 . . . . 72.51 110.207 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 50' ' ' LEU . 82.7 mt -79.15 -24.38 43.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.531 -0.759 . . . . 70.34 111.627 -178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -136.44 -75.51 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.645 0.239 . . . . 72.41 111.645 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.641 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.3 t30 46.33 -86.71 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.887 0.875 . . . . 73.52 112.882 -171.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -91.29 49.68 1.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.639 0.733 . . . . 73.25 110.29 -173.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG22 ' A' ' 60' ' ' VAL . 5.7 ttm-85 -156.44 32.05 0.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.703 -1.221 . . . . 44.24 107.703 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.876 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -73.78 -141.93 0.0 OUTLIER Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.272 0.841 . . . . 43.35 113.272 -166.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.76 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 41.0 Cg_exo -2.53 73.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 122.305 2.003 . . . . 72.14 112.956 -136.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -93.42 116.13 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 114.766 -1.107 . . . . 60.23 111.044 -169.213 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.558 HD23 HG22 ' A' ' 12' ' ' VAL . 32.9 mt -82.65 103.02 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.092 0.472 . . . . 72.54 110.35 173.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 82.1 t80 -95.19 126.05 40.25 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.171 -0.922 . . . . 70.01 110.013 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.98 108.26 15.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.146 -0.479 . . . . 45.15 110.739 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.451 ' CG2' HG23 ' A' ' 11' ' ' VAL . 51.0 t -77.93 147.19 7.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.11 -0.495 . . . . 63.01 109.731 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 67.45 26.35 8.32 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.076 -0.713 . . . . 74.14 109.076 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.575 ' HG2' ' HE2' ' A' ' 68' ' ' LYS . 7.7 tp10 -149.27 -45.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.051 -0.977 . . . . 71.23 109.433 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.503 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 t70 73.28 37.63 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.972 -1.013 . . . . 75.54 111.591 172.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HE2' ' HG2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -149.47 167.04 27.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.137 -0.483 . . . . 74.43 110.045 176.277 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -94.24 157.97 15.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.025 0.44 . . . . 64.14 111.633 -172.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.443 ' CD1' HD13 ' A' ' 80' ' ' ILE . 54.2 mt -112.7 -62.81 1.53 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 62.45 110.033 173.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.3 t -153.8 153.6 32.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 70.13 110.098 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.534 ' CD2' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -128.43 149.35 50.6 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.962 -0.385 . . . . 74.42 109.962 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.411 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 68.0 m-85 74.85 -33.64 0.25 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.81 0.844 . . . . 71.1 113.037 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -141.48 -177.91 5.38 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.016 -0.735 . . . . 75.41 109.016 -174.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 tp -121.1 111.93 18.05 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.779 -0.368 . . . . 74.33 111.195 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -90.69 98.3 11.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.185 -0.672 . . . . 64.41 109.185 175.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.0 m -61.55 -32.09 72.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.09 -0.505 . . . . 72.02 111.635 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.4 -48.33 67.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.86 0.362 . . . . 55.52 110.774 -176.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -66.86 -48.82 78.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.235 -0.439 . . . . 70.14 111.993 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.533 HD11 HD23 ' A' ' 84' ' ' LEU . 8.6 tp -69.69 -30.72 45.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.432 -0.507 . . . . 71.22 110.189 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -30.48 77.69 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.805 -0.712 . . . . 70.11 111.61 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.7 -37.82 55.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.927 0.394 . . . . 74.32 110.697 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -78.69 -54.86 5.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.021 -0.536 . . . . 72.41 111.515 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.559 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -76.3 -38.4 56.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.126 -0.488 . . . . 43.35 110.851 -175.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 115.557 -0.747 . . . . 72.3 111.243 -176.694 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.48 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 41.4 mt-10 . . . . . 0 N--CA 1.446 -0.67 0 N-CA-C 109.504 -0.554 . . . . 73.41 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.48 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 68.4 Cg_endo -68.79 132.12 24.2 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.52 2.147 . . . . 60.35 113.025 -172.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.976 ' NH1' ' O ' ' A' ' 85' ' ' SER . 8.7 ptp180 -88.31 130.34 35.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.589 -0.893 . . . . 75.23 108.589 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.62 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.5 tttt -96.09 155.98 16.53 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.134 0.42 . . . . 71.34 112.134 -166.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.614 HD11 HD11 ' A' ' 80' ' ' ILE . 89.7 mt -125.85 148.3 49.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.908 -0.587 . . . . 71.4 110.215 173.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.609 HG23 HG21 ' A' ' 64' ' ' VAL . 55.1 t -127.03 135.51 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 116.239 -0.437 . . . . 71.3 109.958 175.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.724 HG22 HD23 ' A' ' 61' ' ' LEU . 86.8 t -108.85 119.62 58.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.344 -0.389 . . . . 50.34 110.155 176.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -95.9 115.84 28.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.843 -0.429 . . . . 63.51 109.843 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -139.07 -170.48 11.86 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.379 -0.915 . . . . 65.02 112.104 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB2' ' OD2' ' A' ' 45' ' ' ASP . 16.4 ptm180 -154.48 -177.35 6.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.827 -0.434 . . . . 74.12 109.827 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -78.32 155.6 30.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.146 -0.479 . . . . 72.52 110.825 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.33 31.87 45.03 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.937 -0.649 . . . . 52.03 112.138 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.1 m -143.09 94.08 2.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.803 0.335 . . . . 71.33 110.918 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -70.93 -28.75 64.73 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.24 0.543 . . . . 72.42 110.031 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.46 -34.45 64.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.09 -0.959 . . . . 44.34 110.279 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.9 t -68.13 -37.19 80.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 52.32 110.197 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.407 ' HA ' HD12 ' A' ' 25' ' ' ILE . 40.6 mt-10 -68.92 -33.14 73.26 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.217 0.532 . . . . 73.43 110.094 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.08 -36.7 84.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.657 -0.701 . . . . 73.13 110.409 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 85.2 mtp -63.99 -43.97 94.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.026 -0.533 . . . . 43.43 109.928 174.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.0 mt -55.05 -49.57 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.944 -0.571 . . . . 60.51 110.99 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.15 93.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.933 0.397 . . . . 72.01 110.919 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -62.98 -41.36 99.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.798 -0.637 . . . . 64.14 110.688 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.549 HD23 HD13 ' A' ' 39' ' ' LEU . 8.3 mp -66.45 -33.25 75.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.774 -0.648 . . . . 62.14 111.396 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.36 -42.19 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.893 0.378 . . . . 71.41 110.372 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.533 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 62.8 t -66.38 -44.37 90.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 64.22 110.71 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.41 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 11.8 mt -63.72 -33.61 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.53 -0.305 . . . . 73.45 111.505 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.628 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 31.3 mt-30 -58.4 -22.41 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.872 0.367 . . . . 72.25 111.898 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 49.6 mtmt -81.91 -11.45 58.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.165 0.507 . . . . 62.4 110.769 -178.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -110.56 -44.23 3.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.622 -0.717 . . . . 71.24 109.961 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.467 ' HB3' HD12 ' A' ' 84' ' ' LEU . 73.0 m -137.92 115.2 11.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.998 -1.001 . . . . 63.25 109.535 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -80.86 125.16 29.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.065 0.46 . . . . 71.02 110.806 -178.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.859 ' HB3' HD11 ' A' ' 84' ' ' LEU . 5.6 p90 -134.37 17.74 3.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.582 -0.736 . . . . 72.25 110.869 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.62 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 12.9 mm-40 59.98 -179.41 0.09 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.33 0.586 . . . . 75.52 110.304 -175.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.628 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 5.2 tp -152.54 112.55 4.0 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.538 -0.465 . . . . 75.52 111.291 172.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.516 ' HB3' HG22 ' A' ' 11' ' ' VAL . 22.7 tt0 -120.01 117.8 28.98 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.412 -0.588 . . . . 72.34 109.412 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.5 t -105.61 108.23 24.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.945 -0.571 . . . . 75.31 109.694 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.4 mt -108.5 113.02 42.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.852 -0.613 . . . . 71.52 110.526 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.453 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.7 m120 -81.1 124.77 29.49 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.644 . . . . 65.44 110.17 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.675 HG22 ' HB3' ' A' ' 50' ' ' LEU . 43.0 pt -69.97 -30.12 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.334 -0.394 . . . . 74.33 110.106 177.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -63.7 94.29 0.09 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.208 0.527 . . . . 63.25 109.874 170.519 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.02 -27.94 2.27 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.55 -1.02 . . . . 70.21 110.55 -174.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -120.65 109.29 15.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.938 -0.393 . . . . 65.51 109.938 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -58.5 -42.75 88.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.048 -0.524 . . . . 75.35 110.712 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -58.48 -41.26 84.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.411 . . . . 74.1 111.25 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.675 ' HB3' HG22 ' A' ' 44' ' ' ILE . 80.9 mt -76.31 -30.33 57.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.585 -0.279 . . . . 63.41 110.901 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.4 m -61.96 -45.35 94.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.085 0.469 . . . . 74.2 110.081 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -63.99 -30.91 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.063 -0.517 . . . . 71.23 110.926 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.07 -44.28 12.41 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.084 0.772 . . . . 75.11 113.084 -174.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.518 ' HB2' HG21 ' A' ' 44' ' ' ILE . 92.7 m-85 -117.03 -2.92 11.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.817 1.043 . . . . 73.53 113.817 -167.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -77.76 82.85 4.13 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 119.485 -0.886 . . . . 71.44 111.219 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.0 t70 171.63 -48.29 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 114.557 -1.201 . . . . 72.1 108.484 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 60' ' ' VAL . 18.0 ptt180 -109.1 54.11 0.67 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.419 -1.264 . . . . 71.13 109.613 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.811 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -144.97 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 112.228 0.455 . . . . 50.44 112.228 -171.402 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.811 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 67.8 Cg_exo -4.89 77.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.642 0 C-N-CA 122.599 2.199 . . . . 64.45 113.72 -138.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -92.12 128.05 43.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.087 -0.96 . . . . 74.22 110.469 -171.641 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.724 HD23 HG22 ' A' ' 12' ' ' VAL . 2.1 tm? -102.03 108.11 19.44 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.381 -0.599 . . . . 75.21 109.381 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -99.86 141.91 32.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.347 -0.842 . . . . 73.52 111.258 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.598 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -92.38 111.5 23.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.594 . . . . 73.22 111.0 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.609 HG21 HG23 ' A' ' 11' ' ' VAL . 21.6 t -99.42 88.37 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.587 0.708 . . . . 44.32 110.819 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 175.29 -44.34 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.045 -1.835 . . . . 73.31 106.045 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 54.1 tt0 -125.53 104.83 8.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.71 -1.586 . . . . 60.2 107.474 163.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -52.12 90.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 124.264 0.977 . . . . 54.24 111.741 -175.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 25.6 pttm -160.85 156.62 25.34 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.842 -1.072 . . . . 64.31 110.105 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -89.84 141.04 29.01 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.637 -0.505 . . . . 74.15 109.637 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.3 mt -94.21 -55.67 3.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.45 110.166 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.2 t -158.63 175.13 14.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.03 -0.532 . . . . 52.1 109.852 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 7.7 p80 -144.2 136.77 26.84 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.802 -0.444 . . . . 52.02 109.802 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 96.0 m-85 73.99 139.56 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.518 1.136 . . . . 63.13 111.268 -174.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 61.15 -141.84 0.5 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.063 -0.971 . . . . 73.51 110.132 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 75' ' ' LEU . 14.0 tp -153.83 113.93 3.91 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.463 -0.495 . . . . 72.4 110.419 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.417 ' OD2' ' HB ' ' A' ' 79' ' ' VAL . 4.4 p-10 -58.66 -38.99 79.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.653 -0.703 . . . . 74.2 109.965 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.68 -49.8 0.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.364 -0.834 . . . . 65.33 112.004 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -79.22 -40.06 31.65 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.618 0.229 . . . . 64.42 111.618 -176.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.417 ' HB ' ' OD2' ' A' ' 76' ' ' ASP . 54.1 t -69.53 -47.65 70.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.62 0.247 . . . . 74.25 110.535 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.614 HD11 HD11 ' A' ' 10' ' ' LEU . 10.2 tp -65.57 -31.07 52.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.845 -0.342 . . . . 54.13 110.095 174.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.66 -29.14 74.48 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 120.768 -0.73 . . . . 64.33 111.61 176.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.73 -39.58 26.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.265 0.555 . . . . 72.34 110.278 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.598 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 82.3 t80 -71.88 -32.07 67.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.576 -0.738 . . . . 75.42 111.493 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.859 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -92.22 8.12 39.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.118 -0.492 . . . . 71.53 111.323 -178.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.976 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 8.3 t . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.176 -0.675 . . . . 52.54 109.176 176.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.592 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.9 pt-20 . . . . . 0 N--CA 1.448 -0.56 0 N-CA-C 108.659 -0.867 . . . . 72.12 108.659 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.592 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.3 Cg_endo -73.46 130.06 14.53 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.855 1.703 . . . . 72.0 111.892 -176.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -96.27 -172.45 2.54 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.931 -0.766 . . . . 71.32 108.931 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 38' ' ' GLU . 26.3 mtpt -139.77 120.09 13.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.235 0.54 . . . . 65.51 111.138 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 80' ' ' ILE . 29.7 mt -107.34 123.64 48.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.349 -0.841 . . . . 72.22 110.59 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.627 HG22 ' HB3' ' A' ' 40' ' ' GLU . 47.8 t -102.28 127.17 56.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.874 -0.603 . . . . 73.13 109.51 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 ' CD2' ' A' ' 61' ' ' LEU . 40.7 t -104.02 108.8 25.47 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.091 -0.504 . . . . 54.42 109.913 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.902 ' HB2' HG12 ' A' ' 60' ' ' VAL . 45.5 m-85 -79.58 112.57 16.97 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.986 -0.746 . . . . 73.43 108.986 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.74 179.67 16.58 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.639 -0.791 . . . . 32.23 112.218 -177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.524 ' HG2' ' HB2' ' A' ' 45' ' ' ASP . 0.3 OUTLIER -151.56 118.57 5.86 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.34 -0.615 . . . . 74.03 109.34 -176.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.69 107.16 0.56 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.933 -0.576 . . . . 61.52 110.883 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.11 -20.01 4.06 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.584 -0.735 . . . . 64.14 111.366 -175.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 15' ' ' ARG . 60.5 m -87.56 118.94 27.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.869 0.366 . . . . 64.25 110.264 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.6 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 33.4 t60 -71.41 -33.56 69.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.51 . . . . 72.34 111.328 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -65.25 -31.01 71.94 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.778 -0.369 . . . . 74.21 110.842 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.406 ' O ' HG13 ' A' ' 25' ' ' ILE . 42.9 t -54.97 -47.31 74.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.989 -178.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 13.9 pt-20 -71.16 -32.22 68.65 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.364 -0.38 . . . . 73.25 110.945 -178.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.0 mt-10 -71.61 -34.9 70.24 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.074 -0.512 . . . . 72.32 110.522 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.79 ' HG3' ' HB3' ' A' ' 59' ' ' PRO . 87.1 mmm -63.83 -43.04 97.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.902 -0.59 . . . . 74.23 110.123 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.623 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 77.1 mt -54.4 -50.58 56.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 74.4 110.78 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.84 -39.74 86.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.343 -0.39 . . . . 65.34 110.973 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -61.64 -44.0 97.8 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.949 -0.569 . . . . 75.23 110.704 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -66.11 -38.46 88.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.96 -0.564 . . . . 51.54 111.299 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.1 mmm180 -58.2 -41.83 84.86 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.676 0.274 . . . . 72.51 111.574 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.558 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 60.0 t -68.89 -40.49 81.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.856 0.36 . . . . 71.11 111.056 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -33.55 70.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.02 0.438 . . . . 63.43 109.92 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.59 -30.15 69.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.53 -0.759 . . . . 72.03 110.742 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 52.7 mtmt -69.28 -33.62 73.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 75.23 110.749 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -83.15 -46.06 13.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.619 -0.718 . . . . 73.5 110.281 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.453 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.9 m -135.22 118.24 16.38 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.661 -0.7 . . . . 74.3 109.511 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -76.99 117.81 18.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.476 0.655 . . . . 63.02 111.447 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -129.34 22.98 5.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.303 -0.862 . . . . 74.22 110.43 177.427 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 19.9 mm-40 57.4 -179.93 0.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.501 -175.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.401 ' HA ' HD12 ' A' ' 39' ' ' LEU . 11.3 tp -152.55 117.03 4.99 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.877 -0.729 . . . . 73.44 110.778 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 11' ' ' VAL . 14.9 tt0 -124.41 117.39 24.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.872 -0.788 . . . . 60.14 108.872 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 56.3 t -109.04 111.43 36.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.305 -0.407 . . . . 73.03 109.905 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.6 mt -117.86 109.93 29.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.062 -0.517 . . . . 73.21 110.741 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.69 124.82 27.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.978 177.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.562 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.7 pt -86.8 -14.55 10.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.56 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.524 ' HB2' ' HG2' ' A' ' 15' ' ' ARG . 13.6 t70 -56.51 -34.67 67.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.841 -0.618 . . . . 75.41 111.82 -174.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.9 27.41 10.09 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.704 -0.76 . . . . 73.25 113.02 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 22.6 t-20 -152.76 115.66 4.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.645 -0.327 . . . . 73.44 110.512 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.69 -34.92 67.9 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.797 0.295 . . . . 73.05 111.797 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 36.5 m80 -69.34 -53.86 17.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.801 -0.444 . . . . 64.32 109.801 -177.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 mt -65.79 -39.45 90.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.757 -0.656 . . . . 74.5 111.381 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 95.2 m -54.24 -57.72 10.11 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 120.612 0.244 . . . . 64.33 110.753 178.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 -67.54 -31.02 70.83 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 121.069 -0.252 . . . . 75.24 111.264 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 49' ' ' HIS . 0.5 OUTLIER -67.19 -52.39 41.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.54 -0.3 . . . . 74.41 111.52 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.555 ' HB2' HD13 ' A' ' 44' ' ' ILE . 70.3 m-85 -111.47 19.74 17.9 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 112.352 0.501 . . . . 73.31 112.352 -173.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HB2' ' O ' ' A' ' 51' ' ' THR . 8.8 t30 -59.83 -37.74 80.08 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.224 0.466 . . . . 62.24 110.568 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -103.07 14.11 32.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.7 0.762 . . . . 70.41 109.741 176.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.494 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 14.2 ttm180 -138.44 29.14 2.44 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.897 -0.592 . . . . 60.11 109.648 -176.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.861 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -84.5 -146.42 0.0 OUTLIER Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 118.525 -0.75 . . . . 64.3 109.729 176.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.861 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 35.1 Cg_exo -2.43 70.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.991 0 C-N-CA 122.351 2.034 . . . . 63.21 112.694 -139.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.902 HG12 ' HB2' ' A' ' 13' ' ' TYR . 4.0 p -116.91 139.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-N 114.553 -1.203 . . . . 74.5 110.396 -165.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.559 ' CD2' HG22 ' A' ' 12' ' ' VAL . 58.6 mt -103.13 110.6 22.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.985 0.421 . . . . 75.05 110.923 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.1 t80 -92.18 120.48 32.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.623 -0.717 . . . . 72.43 109.909 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.97 100.65 9.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.63 . . . . 71.54 110.981 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.54 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.7 t -79.02 98.83 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.336 -0.393 . . . . 54.11 110.291 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 18.1 t-20 168.46 -39.53 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.273 -0.876 . . . . 74.1 108.691 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -125.34 1.87 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.521 -0.763 . . . . 63.12 110.672 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.89 81.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.662 -0.699 . . . . 75.42 111.952 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -173.03 149.6 1.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 73.53 110.043 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 62' ' ' PHE . 1.9 mp0 -88.07 144.93 26.23 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.851 -0.426 . . . . 74.33 109.851 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.4 mt -88.36 -51.33 5.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.014 0.435 . . . . 74.31 110.671 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.7 t -150.79 158.84 44.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 70.24 109.898 -177.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.706 ' HB3' HG23 ' A' ' 60' ' ' VAL . 2.2 p80 -136.17 129.43 31.69 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.661 -0.496 . . . . 64.34 109.661 177.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 73.4 m-85 65.47 121.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 124.18 0.925 . . . . 72.51 110.472 -173.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 72.1 m-85 69.5 171.75 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.193 -0.912 . . . . 61.43 110.767 -175.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.1 tp -123.24 118.3 27.28 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.751 -0.379 . . . . 72.4 111.83 -169.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -92.64 106.24 18.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.915 -0.584 . . . . 53.13 110.026 173.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.1 m -68.52 -39.42 81.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.012 -0.54 . . . . 45.31 111.534 -176.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.46 -41.11 85.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.945 0.402 . . . . 63.55 111.046 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.4 t -66.52 -41.47 88.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 41.22 111.536 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.598 HD11 HD11 ' A' ' 10' ' ' LEU . 8.4 tp -72.55 -31.67 38.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.188 -0.605 . . . . 63.42 110.022 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.58 78.06 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.748 -0.739 . . . . 64.55 111.554 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.14 -29.83 66.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.757 0.313 . . . . 73.33 111.042 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -87.12 -42.26 13.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 74.11 111.556 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.485 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -69.02 -21.18 64.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.065 -0.516 . . . . 74.34 111.95 -174.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.326 -0.452 0 N-CA-C 109.628 -0.508 . . . . 44.13 109.628 176.501 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 . . . . . 0 N--CA 1.442 -0.843 0 N-CA-C 109.833 -0.432 . . . . 63.2 109.833 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -75.51 177.94 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.341 2.027 . . . . 64.34 111.729 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 9.4 mpt_? -91.93 -179.1 5.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.322 -0.622 . . . . 72.12 109.322 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.755 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.3 tmtp? -142.64 115.17 8.53 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.041 0.448 . . . . 70.03 109.918 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 HD11 ' A' ' 80' ' ' ILE . 79.7 mt -105.66 133.37 50.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.941 -0.572 . . . . 73.2 111.131 178.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.6 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 68.2 t -107.34 127.3 63.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.602 -0.726 . . . . 63.02 109.61 172.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 61' ' ' LEU . 92.4 t -96.64 112.13 28.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 120.953 0.406 . . . . 71.44 110.206 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 1.012 ' HB2' HG23 ' A' ' 60' ' ' VAL . 61.1 m-85 -81.91 111.86 18.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.161 -0.472 . . . . 75.54 109.879 175.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.44 ' O ' HG12 ' A' ' 44' ' ' ILE . . . -120.92 -161.72 11.49 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 110.361 -1.096 . . . . 75.42 110.361 176.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.75 ' HG2' HG11 ' A' ' 58' ' ' VAL . 2.1 ptp180 -164.48 -53.52 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.692 0.746 . . . . 63.34 112.28 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -137.08 -175.19 3.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.606 -0.27 . . . . 71.42 111.068 -169.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -79.0 62.61 3.96 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 116.073 -0.512 . . . . 60.02 113.322 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 m -81.84 134.55 35.43 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.212 -0.662 . . . . 71.12 109.212 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.499 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.0 t60 -68.48 -38.66 81.23 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.504 -0.478 . . . . 55.52 109.836 -176.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 20' ' ' LEU . 23.3 mt -57.37 -31.62 65.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.439 -0.346 . . . . 62.2 111.499 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.443 ' O ' HG13 ' A' ' 25' ' ' ILE . 41.9 t -57.62 -49.5 76.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.452 -0.34 . . . . 75.12 110.426 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.4 pt-20 -70.63 -29.2 65.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.783 0.325 . . . . 71.12 110.436 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 38.2 mt-10 -70.1 -39.73 75.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.985 0.421 . . . . 73.34 110.151 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 89.9 mmm -64.62 -45.49 86.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.048 -0.524 . . . . 72.24 110.004 174.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.2 mt -55.41 -49.64 71.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.261 -0.427 . . . . 71.55 110.285 177.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -60.03 -42.81 95.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.706 0.289 . . . . 75.32 110.9 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.2 m -55.79 -49.08 74.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.235 -0.439 . . . . 64.31 110.757 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.467 HD21 HD11 ' A' ' 61' ' ' LEU . 4.2 mm? -67.25 -38.86 85.86 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.155 -0.475 . . . . 73.11 111.155 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 22.8 mmm180 -61.07 -38.75 87.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 64.12 110.987 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.574 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 93.9 t -68.53 -44.28 83.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.258 -0.428 . . . . 63.52 111.101 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.48 -32.22 73.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.153 0.502 . . . . 63.41 109.732 178.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.459 ' HA ' ' O ' ' A' ' 35' ' ' SER . 35.5 tt0 -64.13 -21.64 66.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.598 -0.728 . . . . 71.32 110.404 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 57.7 mtmt -78.45 -11.84 59.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.585 -0.734 . . . . 71.31 110.943 177.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.18 -48.48 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.168 0.508 . . . . 73.13 109.716 173.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.473 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.7 m -133.81 127.99 33.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.405 -0.816 . . . . 73.25 110.209 -177.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -82.22 131.3 35.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.217 0.532 . . . . 74.13 111.354 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.534 ' HB3' HD21 ' A' ' 84' ' ' LEU . 7.5 p90 -140.21 22.01 2.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.419 -0.81 . . . . 75.25 110.697 177.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 58.2 -176.08 0.08 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.135 -0.484 . . . . 64.21 110.402 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.28 137.03 19.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.759 -0.46 . . . . 62.1 109.759 175.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.723 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 4.2 tp10 -136.71 143.42 43.34 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.139 -0.689 . . . . 73.33 109.139 174.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -127.9 109.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.999 -0.371 . . . . 73.21 109.999 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.519 HD12 HG11 ' A' ' 11' ' ' VAL . 75.9 mt -123.99 109.85 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.309 -0.405 . . . . 54.41 110.881 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.443 HD22 ' C ' ' A' ' 15' ' ' ARG . 10.8 m120 -81.53 111.42 17.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.219 -0.446 . . . . 62.55 110.129 176.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.558 HD13 ' HB2' ' A' ' 54' ' ' TYR . 48.4 pt -76.97 -2.01 4.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 71.31 111.153 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 35.3 t70 -61.96 -32.66 73.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.099 -0.501 . . . . 45.22 110.766 -178.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -95.53 0.58 63.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.918 -0.658 . . . . 61.21 112.116 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.68 97.82 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.716 -0.476 . . . . 74.54 109.716 -179.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -58.79 -43.04 90.38 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.735 -0.666 . . . . 54.34 111.276 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -76.08 -30.51 58.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.677 0.275 . . . . 60.45 110.851 -172.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.17 -26.69 53.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.818 0.342 . . . . 70.03 110.71 176.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.503 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 50.5 m -59.89 -37.68 80.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.635 176.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -56.41 -32.56 64.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.165 0.507 . . . . 73.15 110.706 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.15 -57.5 2.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.774 -0.648 . . . . 74.22 111.572 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.6 m-85 -104.51 13.66 31.37 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.116 0.784 . . . . 73.03 113.116 -166.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 51' ' ' THR . 12.6 t30 -52.59 -58.22 7.49 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.341 0.519 . . . . 55.53 111.852 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -90.7 -3.18 57.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.023 0.439 . . . . 64.43 111.3 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.25 74.52 1.24 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.969 -0.752 . . . . 71.43 108.969 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.857 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -100.52 -141.17 0.0 OUTLIER Pre-proline 0 N--CA 1.439 -1.01 0 CA-C-O 118.37 -0.824 . . . . 74.13 109.835 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.857 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 77.2 Cg_exo -9.03 71.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.806 0 C-N-CA 122.778 2.318 . . . . 72.34 114.351 -140.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 1.012 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -103.89 136.26 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.423 -0.808 . . . . 75.34 111.583 -173.373 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.6 HD23 HG22 ' A' ' 12' ' ' VAL . 96.1 mt -93.32 109.22 20.77 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.488 -0.778 . . . . 63.31 110.216 177.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.6 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.0 t80 -92.08 125.5 36.79 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.362 -0.835 . . . . 74.31 109.937 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -82.64 104.94 13.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 72.24 110.566 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 85.5 t -70.9 154.29 8.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.567 -0.531 . . . . 74.01 109.567 177.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 87.0 m-20 78.98 -38.03 0.2 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.714 0.806 . . . . 62.23 110.145 -174.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.588 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 51.8 mm-40 -87.13 -33.61 19.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.859 -0.61 . . . . 72.43 111.031 175.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 61.7 66.34 0.85 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.561 0.696 . . . . 65.35 109.905 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.588 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 3.2 ptpp? -160.23 153.51 21.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.294 -0.866 . . . . 75.45 109.992 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 mp0 -87.66 144.19 26.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.34 -0.615 . . . . 71.2 109.34 174.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.2 mt -109.99 -56.51 2.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.023 0.44 . . . . 74.14 111.291 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 46.6 t -140.76 157.49 45.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.897 -0.592 . . . . 72.52 110.472 -169.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 18.3 p-80 -127.63 -171.96 2.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.344 -0.613 . . . . 74.34 109.344 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 13.0 p90 -48.88 144.27 4.74 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.606 0.241 . . . . 71.02 111.548 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 36.3 m-85 71.1 90.15 0.1 Allowed 'General case' 0 C--O 1.236 0.355 0 O-C-N 124.101 0.875 . . . . 65.22 108.827 -165.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.72 126.2 25.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.659 -1.155 . . . . 74.14 111.522 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -75.15 -35.96 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.763 -0.653 . . . . 75.13 110.238 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.37 -48.19 0.68 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.099 -0.955 . . . . 74.23 112.278 178.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.45 -50.6 58.49 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.819 0.303 . . . . 51.12 111.819 -175.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.6 -51.24 75.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 111.782 0.29 . . . . 54.33 111.782 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.793 HD11 HD23 ' A' ' 84' ' ' LEU . 7.1 tp -68.47 -29.57 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 119.834 -0.746 . . . . 74.15 110.298 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.04 -41.35 97.26 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.684 -0.77 . . . . 73.03 111.582 176.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.37 -26.38 68.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.28 0.562 . . . . 62.22 110.633 176.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.428 ' CE2' ' HG2' ' A' ' 8' ' ' ARG . 85.1 t80 -88.0 -50.37 6.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.796 -0.638 . . . . 73.32 111.52 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.793 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -76.52 -39.18 53.74 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.335 0.495 . . . . 73.54 112.335 -172.123 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.7 p . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.778 -0.369 . . . . 74.52 111.345 -173.919 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 35.8 mt-10 . . . . . 0 N--CA 1.449 -0.513 0 N-CA-C 110.665 -0.124 . . . . 74.15 110.665 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 59.3 Cg_endo -69.4 173.62 10.39 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.754 2.303 . . . . 72.35 112.896 -175.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.529 ' HG3' ' HA ' ' A' ' 84' ' ' LEU . 0.5 OUTLIER -108.26 -170.23 1.64 Allowed 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.042 -0.725 . . . . 73.02 109.042 178.093 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 83.6 tttt -146.58 128.68 15.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.081 0.467 . . . . 74.32 110.57 171.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.602 HD11 HD11 ' A' ' 80' ' ' ILE . 80.6 mt -114.96 129.82 56.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 62.41 110.212 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -107.63 126.36 63.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.061 -0.518 . . . . 54.32 109.704 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.575 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 55.8 t -106.09 108.66 25.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.284 0.564 . . . . 63.13 110.058 176.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.674 ' HB2' HG23 ' A' ' 60' ' ' VAL . 96.1 m-85 -81.68 110.62 17.2 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 72.43 109.069 174.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -113.95 171.06 13.58 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.448 -0.882 . . . . 51.22 113.019 -173.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HB2' HG11 ' A' ' 58' ' ' VAL . 45.5 ttt180 -159.32 21.7 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.386 -0.968 . . . . 74.22 108.386 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 62.07 -97.64 0.07 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.248 -1.342 . . . . 60.24 110.191 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.47 -89.05 1.31 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.898 -0.668 . . . . 72.43 113.103 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.3 t -143.07 -167.69 2.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.77 0.319 . . . . 54.12 110.944 -173.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.488 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 22.5 m-70 -69.15 -30.52 68.78 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 113.047 0.758 . . . . 73.14 113.047 -169.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 73' ' ' TYR . 32.4 mt -53.47 -31.29 45.08 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 120.873 -0.331 . . . . 64.11 111.605 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.473 ' O ' HG13 ' A' ' 25' ' ' ILE . 27.1 t -60.14 -48.45 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.492 -0.322 . . . . 72.22 110.912 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.3 pt-20 -73.95 -32.86 63.67 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.754 0.311 . . . . 73.41 110.762 -178.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.09 -41.14 96.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.201 0.524 . . . . 75.34 110.06 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.619 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 89.4 mmm -65.27 -46.34 80.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.718 -0.674 . . . . 71.01 110.803 176.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.481 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.8 mt -56.55 -48.2 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.335 -0.393 . . . . 64.34 111.497 -178.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.17 92.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.068 0.461 . . . . 62.14 110.936 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.6 m -64.67 -39.11 93.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.866 -0.606 . . . . 61.13 111.272 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 24' ' ' MET . 83.3 mt -63.41 -38.72 92.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 74.15 110.95 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.3 mmm180 -62.87 -42.72 99.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.913 -177.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.448 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 68.1 t -71.28 -42.48 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.376 -0.375 . . . . 74.45 110.983 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -66.02 -31.87 73.02 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.048 -0.353 . . . . 71.31 110.048 -179.657 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.44 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -57.99 -28.94 64.86 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.965 0.412 . . . . 75.4 110.907 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 48.4 mtmt -79.86 -12.49 59.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 72.23 110.868 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -103.63 -41.73 5.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 73.43 109.748 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.418 ' HB3' HD12 ' A' ' 84' ' ' LEU . 43.5 m -148.52 119.13 7.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.089 -0.959 . . . . 71.13 109.13 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -72.28 129.58 38.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 64.24 111.239 -176.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 p90 -139.53 21.7 2.53 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.67 -0.695 . . . . 72.11 110.932 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.561 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 22.9 mm-40 59.15 -177.62 0.09 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.94 0.4 . . . . 65.11 110.309 -177.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.44 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 7.0 tp -154.3 109.96 3.18 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.485 -0.486 . . . . 64.32 110.476 168.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -114.75 117.87 31.98 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.425 -0.583 . . . . 73.34 109.425 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.7 t -110.84 110.3 31.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.902 -0.59 . . . . 75.12 110.249 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.1 mt -119.6 111.26 32.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.167 -0.47 . . . . 64.33 110.544 -176.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.2 m120 -81.16 113.95 19.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.25 -0.432 . . . . 61.33 110.175 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 51' ' ' THR . 33.8 pt -79.4 0.01 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.926 -0.579 . . . . 73.53 111.964 -173.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.2 -39.52 90.52 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.088 0.471 . . . . 73.34 111.062 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.03 8.73 68.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.777 -0.725 . . . . 65.1 112.753 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -137.71 97.48 3.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.735 0.268 . . . . 74.52 110.557 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 48' ' ' GLU . 3.9 mp0 -54.22 -33.94 59.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.282 -0.417 . . . . 63.14 110.456 178.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.3 m170 -57.19 -48.95 77.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.5 -0.773 . . . . 71.23 110.064 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' A' ' 53' ' ' LEU . 90.8 mt -77.84 -26.8 49.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.811 -0.632 . . . . 72.41 111.087 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.591 ' HA ' HD12 ' A' ' 44' ' ' ILE . 85.5 m -56.37 -48.97 75.76 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.296 -0.411 . . . . 42.32 111.24 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -66.39 -31.7 72.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.838 0.351 . . . . 75.53 110.836 -176.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 50' ' ' LEU . 71.0 mt -64.32 -48.49 75.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.888 -0.596 . . . . 61.12 111.314 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 44' ' ' ILE . 81.7 m-85 -119.08 24.84 10.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.43 -0.35 . . . . 72.41 111.905 -172.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 51' ' ' THR . 28.1 t-20 -62.36 120.72 11.57 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.023 -0.271 . . . . 73.15 110.43 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' ASN . 20.8 t70 71.66 -3.49 2.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.752 0.786 . . . . 62.4 110.614 -176.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -115.43 32.91 5.76 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.195 -0.669 . . . . 60.43 109.195 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.782 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -82.51 -140.85 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.662 0 CA-C-O 118.636 -0.697 . . . . 64.34 111.071 -176.424 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.782 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 28.1 Cg_exo -3.89 69.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.729 0 C-N-CA 122.536 2.157 . . . . 63.51 113.278 -139.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.674 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -92.08 131.41 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-N 114.641 -1.163 . . . . 73.44 110.837 -172.215 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 10' ' ' LEU . 2.3 tm? -97.65 101.99 13.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.591 -0.892 . . . . 64.32 108.591 174.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.2 t80 -95.29 124.55 39.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.866 -1.061 . . . . 72.53 110.435 -175.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 106.17 17.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.052 -0.522 . . . . 63.12 110.58 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.49 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 58.3 t -67.72 152.85 9.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.558 -0.534 . . . . 71.33 109.558 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 92.8 m-20 76.74 -39.01 0.33 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.528 0.731 . . . . 64.03 110.551 -176.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.86 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 21.2 mm-40 -76.73 -35.98 57.44 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.44 -0.578 . . . . 74.54 109.44 170.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 0.5 OUTLIER 61.51 41.7 12.24 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.89 -1.05 . . . . 74.13 109.479 179.509 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.86 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 1.2 ptpp? -142.15 164.5 30.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.036 -0.984 . . . . 73.1 110.471 -178.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -87.47 134.68 33.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.209 -0.451 . . . . 75.34 110.079 174.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.27 -49.99 6.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.255 -0.646 . . . . 71.25 109.255 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.9 t -168.15 165.97 13.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.984 -0.747 . . . . 52.51 108.984 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.607 ' HD2' ' CD2' ' A' ' 73' ' ' TYR . 49.5 p-80 -144.17 143.99 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 121.202 -0.199 . . . . 63.54 110.661 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.607 ' CD2' ' HD2' ' A' ' 72' ' ' HIS . 64.3 m-85 74.15 -34.65 0.28 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 124.129 0.893 . . . . 72.23 111.785 -176.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -126.51 165.48 19.05 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.616 -0.513 . . . . 54.14 109.616 -176.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.7 tp -119.71 103.37 9.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.987 0.422 . . . . 72.41 111.017 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.29 96.63 10.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.812 -0.631 . . . . 64.21 109.567 174.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.514 ' HA ' HG22 ' A' ' 80' ' ' ILE . 8.6 m -61.56 -30.1 70.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.674 -0.693 . . . . 72.21 111.472 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -64.18 -42.53 96.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 74.12 110.558 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 71.0 t -75.52 -44.37 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 71.21 111.359 -177.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.602 HD11 HD11 ' A' ' 10' ' ' LEU . 8.0 tp -66.44 -34.32 69.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.358 -0.537 . . . . 72.23 110.269 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.08 91.49 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.882 -0.675 . . . . 74.04 111.779 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.77 -33.38 75.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 64.14 111.038 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -87.35 -40.19 14.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.971 -0.559 . . . . 74.23 111.88 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.604 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -76.8 2.41 14.52 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.699 0.629 . . . . 71.24 112.699 -171.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--N 1.319 -0.729 0 N-CA-C 110.224 -0.288 . . . . 63.32 110.224 176.342 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.589 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 12.0 pt-20 . . . . . 0 C--O 1.238 0.484 0 CA-C-O 120.948 0.404 . . . . 55.01 111.126 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 58.9 Cg_endo -71.98 144.74 43.51 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.306 2.004 . . . . 73.1 112.312 -177.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.569 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -111.9 138.79 48.04 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.82 -0.807 . . . . 72.5 108.82 175.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.586 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 77.9 tttt -88.05 149.79 23.77 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.281 0.562 . . . . 54.51 112.501 -167.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 80' ' ' ILE . 75.2 mt -115.45 131.78 56.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.274 -0.876 . . . . 75.55 110.717 174.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.591 HG23 ' CG2' ' A' ' 64' ' ' VAL . 52.5 t -104.33 133.81 47.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 75.22 109.42 172.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.481 HG22 HD23 ' A' ' 61' ' ' LEU . 21.8 t -98.86 105.7 17.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 C-N-CA 120.165 -0.614 . . . . 75.54 109.426 172.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.75 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 23.6 m-85 -72.13 154.42 41.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 109.189 -0.671 . . . . 73.12 109.189 174.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.581 ' HA2' HG12 ' A' ' 58' ' ' VAL . . . 156.01 -145.27 11.98 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.248 -0.977 . . . . 64.15 111.963 175.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.619 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 8.9 ptm180 -161.03 177.27 10.5 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.447 -0.575 . . . . 73.42 109.447 176.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -77.88 111.48 13.75 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.113 0.482 . . . . 75.23 111.656 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.71 63.43 0.2 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.852 -0.613 . . . . 64.12 112.669 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -148.38 115.34 6.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 71.33 110.814 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.455 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 57.1 t60 -70.91 -39.14 72.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.359 -0.382 . . . . 60.11 111.388 -176.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.441 HD23 ' OE2' ' A' ' 23' ' ' GLU . 15.8 mt -59.72 -31.18 69.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.877 0.37 . . . . 62.22 110.986 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.586 ' O ' HG13 ' A' ' 25' ' ' ILE . 35.3 t -61.04 -45.89 92.93 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.591 -0.522 . . . . 60.03 109.591 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.416 ' O ' ' HB ' ' A' ' 25' ' ' ILE . 30.2 mt-10 -60.73 -47.75 84.9 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.853 -0.612 . . . . 53.22 110.733 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 31.9 mt-10 -63.22 -38.3 90.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.419 -0.809 . . . . 73.1 111.619 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.566 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 45.5 mtp -72.13 -27.94 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.667 -0.413 . . . . 74.4 110.852 177.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 21' ' ' CYS . 67.6 mt -59.12 -45.91 92.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.986 -0.375 . . . . 70.45 109.986 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.97 -41.73 96.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.088 -0.505 . . . . 64.31 110.746 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 m -65.18 -42.38 93.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.009 -0.541 . . . . 73.33 110.719 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 24' ' ' MET . 79.0 mt -67.27 -31.95 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 74.04 111.101 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm-85 -62.11 -44.02 97.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.07 0.462 . . . . 71.54 110.156 175.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.57 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 57.9 t -62.97 -41.46 92.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 53.44 110.492 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -68.1 -33.86 75.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.359 -0.382 . . . . 71.23 110.284 179.349 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.472 ' HA ' ' O ' ' A' ' 35' ' ' SER . 39.8 mt-30 -61.23 -20.86 63.3 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.754 0.312 . . . . 61.31 111.484 177.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.8 mtmt -78.74 -17.72 55.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.168 0.509 . . . . 71.42 110.687 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -99.09 -45.98 5.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 74.14 109.563 176.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 25.5 m -144.88 122.83 12.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.367 -0.833 . . . . 71.11 109.559 -178.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -78.68 135.33 37.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.642 0.258 . . . . 72.53 110.651 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 8.2 p90 -146.01 14.23 1.32 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.487 -0.324 . . . . 74.11 111.561 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.559 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 16.7 mt-10 54.9 -174.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.626 0.726 . . . . 53.52 111.203 -175.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 39' ' ' LEU . 6.0 tp -150.85 109.8 3.89 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.83 -0.623 . . . . 73.45 110.351 174.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.586 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 6.2 tp10 -108.7 147.17 32.33 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 75.24 110.225 -178.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -123.65 125.62 71.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.605 -0.517 . . . . 73.45 109.605 176.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 HG11 ' A' ' 11' ' ' VAL . 77.7 mt -135.43 119.87 26.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.919 0.39 . . . . 61.52 110.804 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.619 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 42.6 m-80 -80.66 129.61 34.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 61.14 111.311 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.0 pt -88.56 -15.48 9.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.948 -0.569 . . . . 71.14 110.323 175.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -48.48 -45.67 37.16 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.283 -0.872 . . . . 74.14 112.472 -172.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -87.78 -0.58 83.66 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.654 -0.784 . . . . 64.32 113.276 -176.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 50' ' ' LEU . 51.8 m-80 -110.42 111.82 23.34 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.165 -0.309 . . . . 72.32 110.165 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.28 -47.29 78.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.995 -0.548 . . . . 72.2 111.721 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -70.75 -37.9 73.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.69 0.281 . . . . 74.3 110.475 -174.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 47' ' ' ASN . 69.3 mt -69.22 -33.07 72.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 54.43 110.54 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.475 ' HA ' HD12 ' A' ' 44' ' ' ILE . 94.3 m -57.69 -56.76 17.72 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.188 -0.46 . . . . 51.25 110.475 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.822 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.54 -29.9 68.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.753 0.279 . . . . 75.15 111.753 -178.437 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.6 mt -75.76 -48.13 23.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.466 0.543 . . . . 71.32 112.466 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.534 ' HB2' HD13 ' A' ' 44' ' ' ILE . 51.0 m-85 -122.83 7.87 9.37 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 113.621 0.971 . . . . 70.34 113.621 -167.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.8 t-20 -59.86 -50.42 73.86 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 118.746 0.703 . . . . 74.24 111.766 -176.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -77.12 -20.58 55.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.907 -0.588 . . . . 62.54 111.169 -175.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -128.63 75.15 1.61 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.303 -0.628 . . . . 70.43 109.303 175.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.869 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.19 -142.92 0.0 OUTLIER Pre-proline 0 N--CA 1.438 -1.061 0 CA-C-O 117.823 -1.084 . . . . 64.51 109.335 176.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.869 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 94.7 Cg_exo -10.96 101.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.954 0 C-N-CA 122.32 2.013 . . . . 74.31 113.787 -141.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.621 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -129.43 142.82 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 123.427 0.455 . . . . 52.12 110.98 -176.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 1.047 ' HG ' ' HD2' ' A' ' 72' ' ' HIS . 22.7 mt -88.11 123.3 32.63 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.094 0.473 . . . . 75.03 111.539 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.509 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 89.7 t80 -105.28 129.9 53.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.083 -0.962 . . . . 74.51 110.296 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.423 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -80.43 104.07 10.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.165 -0.47 . . . . 53.03 110.926 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.591 ' CG2' HG23 ' A' ' 11' ' ' VAL . 46.9 t -80.79 81.78 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.964 0.412 . . . . 75.21 110.668 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 30.5 t-20 172.92 -59.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.124 -0.944 . . . . 64.22 108.963 177.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.05 -7.9 52.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.554 -0.748 . . . . 73.1 110.35 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.4 t70 60.58 78.79 0.27 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.522 0.677 . . . . 74.44 111.395 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -171.42 148.42 2.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.486 -0.779 . . . . 74.11 110.932 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.2 137.69 38.28 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.748 -0.464 . . . . 52.34 109.748 174.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 mt -98.97 -82.41 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.9 0.381 . . . . 73.42 110.447 178.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.402 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 45.6 t -166.37 148.59 6.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 64.05 109.96 -177.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 1.047 ' HD2' ' HG ' ' A' ' 61' ' ' LEU . 4.9 t-80 -146.28 -170.54 3.52 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.483 -0.562 . . . . 75.51 109.483 176.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 55.5 m-85 101.39 -75.74 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.306 1.443 . . . . 72.44 111.412 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -125.56 8.03 7.65 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.174 -0.21 . . . . 72.24 111.272 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.7 tp 71.88 122.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.972 0.795 . . . . 64.43 111.913 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.402 ' OD1' ' HB3' ' A' ' 71' ' ' CYS . 6.1 p-10 -85.56 -40.3 16.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.677 -0.692 . . . . 64.33 110.894 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 61.35 21.17 11.75 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.89 -0.596 . . . . 53.43 111.242 -177.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -127.24 -53.0 1.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.355 0.598 . . . . 73.24 110.354 -175.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.3 t -75.76 -42.93 40.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.514 -0.767 . . . . 72.25 109.904 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.625 HD11 HD23 ' A' ' 84' ' ' LEU . 7.7 tp -66.05 -31.62 54.49 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.239 0 N-CA-C 109.604 -0.517 . . . . 41.02 109.604 174.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.6 -30.14 75.9 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.824 -0.703 . . . . 62.21 111.717 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.57 -27.62 51.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.086 0.469 . . . . 73.45 110.505 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.569 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 69.4 t80 -87.35 -45.41 10.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 65.1 111.817 -177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.625 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -74.9 -8.51 56.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.142 -0.481 . . . . 71.11 111.783 -172.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.815 -0.439 . . . . 65.24 109.815 175.082 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 109.994 -0.373 . . . . 73.42 109.994 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -86.83 174.4 5.6 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.435 2.09 . . . . 72.13 112.903 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD2' ' N ' ' A' ' 8' ' ' ARG . 2.0 mpt_? -107.58 -176.87 3.19 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.258 -1.015 . . . . 72.14 108.258 176.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.9 tmtp? -150.33 132.34 15.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.415 -0.587 . . . . 72.11 109.415 175.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.587 HD13 HD11 ' A' ' 61' ' ' LEU . 92.7 mt -127.77 138.96 52.92 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 63.22 110.57 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.51 HG22 ' HB3' ' A' ' 40' ' ' GLU . 77.0 t -114.88 137.84 47.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 62.31 110.08 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.608 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -110.14 113.48 44.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.997 0.427 . . . . 73.54 110.18 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.969 ' HB2' HG23 ' A' ' 60' ' ' VAL . 95.2 m-85 -87.11 128.33 35.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.929 -0.767 . . . . 73.52 108.929 174.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.526 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -172.82 -163.15 26.12 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.188 -1.006 . . . . 64.33 111.91 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 13.1 ptm180 -150.69 132.22 14.77 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.369 -0.604 . . . . 73.05 109.369 175.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.49 118.62 7.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.674 -0.694 . . . . 71.03 111.042 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.06 -20.68 1.94 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.38 -0.827 . . . . 64.2 111.601 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.3 p -96.43 128.83 43.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.795 0.331 . . . . 74.24 110.266 177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -69.33 -33.73 73.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.213 0.449 . . . . 74.42 112.213 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 73' ' ' TYR . 20.4 mt -58.61 -32.02 68.6 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.758 0.313 . . . . 75.32 111.258 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.86 -42.38 93.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 65.41 110.265 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.08 -45.49 91.85 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.111 -0.495 . . . . 74.11 110.386 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.452 ' OE2' HD23 ' A' ' 20' ' ' LEU . 45.6 mt-10 -61.89 -40.08 94.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.443 -0.799 . . . . 74.01 111.144 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.535 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.6 mtp -68.72 -49.19 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.241 -0.436 . . . . 62.52 110.698 177.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -58.77 -47.64 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-N 116.717 -0.22 . . . . 70.01 111.432 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -36.68 74.16 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.094 0.473 . . . . 53.23 111.076 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.6 m -69.72 -41.44 75.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.873 -0.603 . . . . 63.42 110.66 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 24' ' ' MET . 86.1 mt -66.66 -34.32 77.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.301 -0.408 . . . . 74.44 111.018 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -61.55 -41.84 97.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.34 111.236 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.71 -37.56 43.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.866 0.365 . . . . 75.14 110.596 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 1.5 mt -64.48 -31.93 73.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 71.2 110.887 178.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.584 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 32.3 mt-30 -52.52 -34.52 50.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.123 -0.49 . . . . 71.31 111.704 176.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -73.86 -23.97 59.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 72.52 111.357 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -93.65 -42.59 9.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.397 0.618 . . . . 73.23 109.965 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB2' HD13 ' A' ' 84' ' ' LEU . 69.9 m -143.54 104.03 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.924 -1.035 . . . . 73.43 109.198 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.7 t-105 -69.27 129.79 40.8 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.898 0.38 . . . . 71.44 111.702 -174.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 30.4 p90 -142.12 18.18 2.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.777 -0.647 . . . . 75.14 111.596 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 59.5 -179.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.032 0.444 . . . . 75.1 110.402 -177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.584 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.9 tp -153.14 132.19 12.6 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 120.099 -0.641 . . . . 72.33 110.808 170.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 7.7 tt0 -136.76 118.19 14.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.551 -0.537 . . . . 72.31 109.551 178.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -107.1 115.82 49.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.525 -0.546 . . . . 71.02 109.525 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.8 mt -115.83 119.69 62.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.775 -175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.539 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 12.0 m-80 -78.23 117.37 19.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 74.43 111.39 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.462 HG22 HD13 ' A' ' 50' ' ' LEU . 23.9 pt -81.01 -7.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 73.33 109.352 174.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -37.69 -46.97 0.94 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.25 -1.341 . . . . 64.15 113.329 -177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.86 32.41 6.93 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.269 -0.967 . . . . 70.33 113.933 -175.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -139.08 100.28 3.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.069 0.435 . . . . 71.31 110.585 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HA ' ' HB ' ' A' ' 51' ' ' THR . 3.7 mp0 -55.38 -33.78 63.74 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.103 0.409 . . . . 73.12 112.103 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -56.89 -45.22 82.74 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.09 -0.337 . . . . 60.32 110.09 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.462 HD13 HG22 ' A' ' 44' ' ' ILE . 80.2 mt -78.64 -39.56 36.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.179 -0.464 . . . . 70.13 110.471 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.501 ' HB ' ' HA ' ' A' ' 48' ' ' GLU . 88.0 m -56.09 -54.03 49.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.194 -0.457 . . . . 54.53 111.679 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -59.06 -30.55 68.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.981 0.42 . . . . 74.21 110.972 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.9 mt -77.05 -53.82 7.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.078 -0.51 . . . . 55.32 111.906 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.451 ' HB2' HD13 ' A' ' 44' ' ' ILE . 59.3 m-85 -116.27 -0.2 12.68 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.487 1.292 . . . . 74.24 114.487 -165.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -59.35 -39.91 84.7 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.843 1.202 . . . . 74.41 111.163 -176.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -84.65 -14.42 48.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.792 -0.64 . . . . 74.24 110.951 178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.412 ' HG3' ' CE2' ' A' ' 73' ' ' TYR . 13.0 ttm180 -143.97 54.12 1.3 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.315 -0.624 . . . . 74.3 109.315 -167.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.584 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.26 -102.66 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.522 0 CA-C-O 118.444 -0.789 . . . . 72.34 111.069 -172.206 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.584 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 16.6 Cg_exo -23.17 75.06 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 122.567 2.178 . . . . 65.04 113.693 -145.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.969 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -102.05 115.51 44.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.719 . . . . 75.43 111.251 -169.229 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.608 HD23 HG22 ' A' ' 12' ' ' VAL . 3.0 tm? -89.19 110.25 21.03 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.572 -0.74 . . . . 61.34 109.587 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -92.25 127.15 37.63 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.111 -0.95 . . . . 72.33 110.693 -176.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.28 95.83 7.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.425 -0.807 . . . . 65.3 111.211 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.527 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 42.2 t -77.63 90.76 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.3 0.572 . . . . 72.21 109.487 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 22.8 t-20 172.19 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.844 -1.071 . . . . 70.1 108.659 -173.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -124.05 -2.59 8.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 64.24 109.928 -178.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 58.71 78.74 0.24 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.098 -0.955 . . . . 71.1 112.035 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -174.33 -179.41 1.59 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.39 -0.823 . . . . 75.32 110.332 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -95.09 141.78 28.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.45 -0.341 . . . . 62.22 110.777 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -96.02 -53.9 3.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.388 0.613 . . . . 73.31 109.559 170.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.7 t -156.77 155.47 31.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.312 -0.858 . . . . 71.44 109.374 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 0.5 OUTLIER -145.09 163.8 33.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.568 -0.287 . . . . 60.25 110.382 179.253 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.503 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 62.5 m-85 74.55 -56.63 0.63 Allowed 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.114 0.884 . . . . 71.5 110.951 -174.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -129.93 -161.95 1.16 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.007 -1.108 . . . . 71.14 108.007 -175.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.8 tp -129.85 113.48 14.71 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.079 -0.648 . . . . 54.41 111.886 -175.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -86.09 86.07 7.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.082 -0.71 . . . . 73.32 109.082 169.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.7 m -59.03 -28.23 66.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 64.22 111.381 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.46 -37.4 68.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.193 -0.458 . . . . 75.35 110.908 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 40.5 t -70.89 -46.59 67.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.193 -0.458 . . . . 70.33 110.977 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.512 HD11 HD11 ' A' ' 10' ' ' LEU . 6.9 tp -68.74 -28.18 38.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.346 -0.541 . . . . 64.42 109.992 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.78 -30.64 78.26 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 111.448 -0.661 . . . . 72.52 111.448 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.3 -33.03 64.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.187 0.517 . . . . 64.11 110.377 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -80.41 -51.42 8.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.96 -0.563 . . . . 71.35 111.038 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 35' ' ' SER . 13.3 mt -64.87 -50.93 64.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.707 -0.679 . . . . 62.24 111.516 -177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.576 0.548 . . . . 62.2 111.396 -172.943 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 34.4 mt-10 . . . . . 0 N--CA 1.445 -0.696 0 N-CA-C 109.748 -0.464 . . . . 73.2 109.748 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 45.3 Cg_endo -62.34 158.67 39.19 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.654 2.236 . . . . 71.23 113.329 -169.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.2 mmp_? -99.2 -164.36 1.12 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.935 -0.765 . . . . 54.43 108.935 175.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.965 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 4.3 tmtp? -149.76 128.87 12.73 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.544 -0.462 . . . . 70.32 110.858 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 37' ' ' PHE . 28.4 mt -116.78 138.67 51.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 64.44 111.294 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 40' ' ' GLU . 41.2 t -124.34 136.41 60.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.701 -0.681 . . . . 63.32 110.131 175.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.579 HG22 HD23 ' A' ' 61' ' ' LEU . 78.4 t -108.35 120.42 59.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.688 -0.486 . . . . 74.44 109.688 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -83.41 97.43 8.95 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.688 -0.486 . . . . 74.52 109.688 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.18 -176.12 14.3 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.018 -1.087 . . . . 52.42 112.696 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.748 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.2 ptm180 -158.28 125.44 4.98 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.896 -0.409 . . . . 74.42 109.896 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 55.3 -154.99 0.28 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.963 -0.562 . . . . 70.43 111.592 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.78 145.37 17.41 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.725 -0.75 . . . . 74.53 112.762 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.407 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 51.2 t -156.28 142.81 18.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.431 -0.581 . . . . 75.23 109.431 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 18.4 m170 -60.38 -48.8 80.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 62.5 111.772 -175.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -34.65 78.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.416 -0.356 . . . . 73.12 110.699 -175.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 84.2 m -64.7 -40.63 95.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.39 . . . . 43.13 110.493 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -61.93 -40.5 95.73 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.038 -0.528 . . . . 74.03 110.218 176.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 35.9 mt-10 -64.73 -36.39 84.14 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.726 -0.67 . . . . 71.12 110.942 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.574 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 82.6 mtp -67.26 -44.69 78.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.466 -0.334 . . . . 72.43 110.432 176.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.63 -47.39 82.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.821 0.343 . . . . 74.24 110.897 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.92 87.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.112 -0.495 . . . . 64.03 110.61 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -64.89 -42.33 94.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 71.21 110.887 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 24' ' ' MET . 95.9 mt -59.31 -45.59 90.89 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 116.164 -0.471 . . . . 60.42 110.569 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 28.1 mmm180 -57.73 -42.63 84.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.39 -0.368 . . . . 73.05 111.255 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 98.8 t -64.3 -45.41 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.287 -0.415 . . . . 45.32 111.137 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.95 -32.96 65.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.914 0.388 . . . . 62.41 110.146 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' LEU . 46.8 tt0 -62.78 -26.77 68.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.846 -0.616 . . . . 74.21 110.633 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 47.9 mtmt -63.36 -42.5 98.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.771 -0.65 . . . . 74.21 110.485 173.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -79.06 -37.61 38.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.056 -0.974 . . . . 64.04 110.639 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.632 ' HB3' HD12 ' A' ' 84' ' ' LEU . 46.1 m -145.66 124.68 12.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.527 -0.76 . . . . 75.23 109.628 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -83.72 119.49 24.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.312 0.577 . . . . 74.31 111.041 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.593 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 1.5 p90 -130.96 20.63 4.95 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.536 -0.756 . . . . 75.24 110.926 179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 9.8 mt-10 53.8 -176.83 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.349 0.595 . . . . 75.1 111.027 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.515 HD11 HD13 ' A' ' 28' ' ' LEU . 7.2 tp -152.17 134.9 15.46 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.186 -0.461 . . . . 72.21 110.031 173.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.675 ' HB3' HG22 ' A' ' 11' ' ' VAL . 10.3 tp10 -136.61 143.04 43.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.116 -0.493 . . . . 54.11 110.195 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.2 t -125.75 107.4 17.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.05 -0.722 . . . . 62.24 109.05 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.494 HD12 HG11 ' A' ' 11' ' ' VAL . 62.4 mt -107.86 116.28 50.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.721 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -75.92 106.67 7.63 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.344 -0.844 . . . . 73.33 110.251 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.4 pt -80.17 -9.83 12.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.62 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.59 -42.3 23.61 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.245 -0.889 . . . . 62.03 112.652 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.89 21.06 45.82 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.578 -0.82 . . . . 73.23 113.269 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 19.8 t-20 -129.72 119.62 23.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.028 0.414 . . . . 71.21 110.607 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.23 -20.66 60.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 72.14 111.929 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.402 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 26.8 m80 -77.6 -54.77 6.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.186 0.517 . . . . 74.41 110.363 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.0 mt -65.35 -39.75 92.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.622 -0.717 . . . . 73.32 111.432 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 83.4 m -61.47 -39.57 91.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.988 0.423 . . . . 75.32 110.788 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.07 -31.49 72.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.088 0.47 . . . . 72.34 110.512 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.67 -55.62 4.02 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.741 . . . . 71.32 111.695 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.453 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 49.2 m-85 -109.42 19.55 19.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.104 0.779 . . . . 71.14 113.104 -166.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.638 ' HB2' ' O ' ' A' ' 51' ' ' THR . 60.9 t30 -54.82 -47.48 74.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.175 0.512 . . . . 63.53 111.285 177.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.98 -17.6 56.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.113 -0.494 . . . . 73.41 111.169 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.513 ' HB2' HG23 ' A' ' 60' ' ' VAL . 9.3 ptt180 -128.26 73.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.073 0.464 . . . . 73.33 110.628 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.748 HG11 ' HG2' ' A' ' 15' ' ' ARG . 1.2 m -90.65 -22.6 0.26 Allowed Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 113.399 0.889 . . . . 63.52 113.399 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.505 ' HD3' HG23 ' A' ' 58' ' ' VAL . 3.8 Cg_exo -79.01 49.33 3.12 Favored 'Trans proline' 0 N--CA 1.443 -1.471 0 CA-C-N 120.629 1.26 . . . . 75.0 110.246 164.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.513 HG23 ' HB2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.01 131.44 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.198 -0.91 . . . . 64.44 110.16 -175.271 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.579 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -109.34 118.83 37.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.827 -0.624 . . . . 50.01 110.34 -174.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -106.67 136.71 46.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.004 -0.998 . . . . 73.1 110.842 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HG ' ' A' ' 70' ' ' LEU . . . -94.52 111.06 22.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.257 -0.428 . . . . 64.24 111.085 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.965 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 60.9 t -86.33 98.76 7.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.013 0.435 . . . . 71.22 109.994 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 177.16 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.076 -1.083 . . . . 64.3 108.076 -176.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -106.16 -11.27 16.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.994 -1.003 . . . . 74.15 109.351 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 67.52 86.99 0.13 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 114.767 -1.106 . . . . 72.14 111.584 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -170.5 157.41 5.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.94 -1.027 . . . . 74.45 109.418 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -82.37 133.88 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.688 0.28 . . . . 73.23 110.399 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.496 ' HG ' ' HB2' ' A' ' 63' ' ' ALA . 53.7 mt -92.59 -46.56 7.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.016 0.436 . . . . 75.12 110.395 178.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.0 t -152.46 157.39 41.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.997 -0.547 . . . . 64.34 111.334 -171.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -128.36 128.82 45.25 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.859 -0.793 . . . . 75.43 108.859 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 59' ' ' PRO . 60.5 m-85 67.39 143.8 0.04 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.949 0.781 . . . . 63.34 112.021 -176.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 57.91 -124.16 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.752 -1.113 . . . . 71.02 110.519 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.0 tp -171.19 110.85 0.33 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.94 -0.304 . . . . 74.52 110.732 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.65 89.6 6.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.937 0.399 . . . . 74.11 110.069 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -57.71 -27.9 63.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.333 -0.849 . . . . 62.33 112.07 -176.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.18 -46.09 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 74.31 110.861 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.09 -44.83 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.51 . . . . 71.03 111.281 -176.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 10' ' ' LEU . 6.7 tp -64.99 -28.23 44.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.512 -0.475 . . . . 45.24 109.802 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.34 -36.27 89.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.75 -0.738 . . . . 61.02 111.662 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.98 -26.58 65.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.088 0.471 . . . . 61.11 110.785 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -87.92 -43.14 12.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 72.31 111.344 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.632 HD12 ' HB3' ' A' ' 35' ' ' SER . 1.3 mm? -76.07 -37.32 58.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.511 0.56 . . . . 75.34 112.511 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 121.156 -0.218 . . . . 55.34 110.934 -177.092 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.486 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 7.4 pt-20 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 110.416 -0.216 . . . . 64.21 110.416 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 92.5 Cg_endo -80.35 167.04 19.79 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.513 2.142 . . . . 74.13 113.155 -172.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.596 ' NE ' ' O ' ' A' ' 85' ' ' SER . 80.7 mtt-85 -107.55 -171.92 1.97 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.419 -0.81 . . . . 72.34 109.522 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 48.8 tttt -149.52 139.43 21.93 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.117 -0.633 . . . . 74.02 112.141 -177.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 80' ' ' ILE . 71.2 mt -113.53 130.29 56.38 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.346 -0.843 . . . . 75.12 110.57 173.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.535 HG23 ' CG2' ' A' ' 64' ' ' VAL . 79.8 t -107.07 133.16 52.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.137 -0.69 . . . . 73.44 109.137 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.845 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 11.3 t -96.58 105.56 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 109.574 -0.528 . . . . 73.31 109.574 175.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.535 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 12.8 m-85 -78.23 98.71 5.98 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.933 -0.576 . . . . 75.22 110.256 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.643 ' HA2' ' HD3' ' A' ' 59' ' ' PRO . . . -114.31 -171.57 17.31 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.269 -0.967 . . . . 61.14 112.839 -175.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG2' HG11 ' A' ' 58' ' ' VAL . 10.1 ptm180 -161.97 103.42 1.15 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.766 -0.457 . . . . 72.43 109.766 171.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 73.82 -56.03 0.66 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.209 -0.905 . . . . 72.32 112.689 172.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.41 158.57 26.02 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.283 -0.961 . . . . 72.22 113.544 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.741 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 41.1 t -171.94 128.04 0.6 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.261 0.625 . . . . 74.23 109.8 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -68.0 -42.29 80.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.473 0.178 . . . . 72.34 111.286 -175.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 16.1 mt -61.83 -30.1 70.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.624 -0.262 . . . . 64.21 111.182 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.535 ' O ' HG13 ' A' ' 25' ' ' ILE . 51.4 t -55.93 -50.94 69.35 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.352 -0.24 . . . . 55.25 110.352 177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.24 -39.13 85.61 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.033 -0.531 . . . . 72.31 111.013 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.09 -39.34 89.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.841 -0.618 . . . . 73.43 111.136 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.436 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 15.2 mtp -71.9 -39.18 69.72 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.516 -0.474 . . . . 73.51 110.311 177.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 72.9 mt -54.84 -50.01 64.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 121.347 -0.141 . . . . 54.12 110.759 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.86 84.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.881 0.372 . . . . 74.3 111.17 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -66.96 -44.71 79.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.077 -0.51 . . . . 72.32 110.838 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.42 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 4.2 mm? -67.68 -32.18 72.66 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.32 -0.4 . . . . 72.22 111.31 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 10.0 mmm180 -57.98 -39.02 77.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.446 . . . . 65.13 110.814 178.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.464 ' HA ' ' CE ' ' A' ' 33' ' ' LYS . 80.4 t -67.84 -42.18 85.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.993 -0.549 . . . . 41.23 110.949 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.99 -35.08 77.74 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.808 -0.441 . . . . 75.44 109.808 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 35' ' ' SER . 23.7 tt0 -60.86 -26.59 67.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.584 -0.735 . . . . 63.43 110.656 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.464 ' CE ' ' HA ' ' A' ' 30' ' ' VAL . 54.3 mtmt -74.97 -11.23 60.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.636 -0.711 . . . . 71.11 111.383 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.11 -44.74 4.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 60.12 109.842 173.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 17.6 m -131.21 115.92 16.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.055 -177.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -77.24 132.64 38.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.123 0.487 . . . . 61.5 111.344 -177.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 16.6 p90 -139.99 19.0 2.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.708 -0.678 . . . . 55.15 111.062 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 9' ' ' LYS . 10.2 mm-40 60.82 -179.61 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.946 0.403 . . . . 64.24 111.286 -177.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -151.14 110.59 3.98 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.28 -0.637 . . . . 74.44 109.28 173.023 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -121.72 145.03 48.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.513 -0.312 . . . . 54.43 110.324 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.4 117.8 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.961 -0.385 . . . . 71.41 109.961 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -133.43 128.21 54.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.459 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.643 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 98.7 m-20 -83.54 128.71 34.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 63.32 110.46 176.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.2 pt -64.75 -47.51 88.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.208 -0.451 . . . . 70.51 109.994 175.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.43 ' N ' HG13 ' A' ' 44' ' ' ILE . 36.5 t70 44.57 -97.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.33 1.052 . . . . 74.32 113.629 173.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.09 -3.97 63.31 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.931 -0.652 . . . . 73.02 113.44 -171.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -80.93 84.35 6.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.75 -0.463 . . . . 71.21 109.75 178.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -53.27 -32.51 48.94 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 73.4 111.124 -177.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -55.4 -46.95 76.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.838 -0.619 . . . . 72.41 110.457 175.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.5 -39.88 36.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.273 -0.421 . . . . 71.24 110.876 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.609 ' HA ' HD12 ' A' ' 44' ' ' ILE . 6.9 m -56.34 -42.0 77.01 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.369 -0.378 . . . . 73.32 111.809 -177.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.22 -34.99 77.54 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.294 0.568 . . . . 72.2 111.095 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.9 mt -78.6 -48.52 14.98 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.442 -0.799 . . . . 74.43 111.33 -176.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.469 ' O ' HG13 ' A' ' 58' ' ' VAL . 62.4 m-85 -114.18 14.79 18.25 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.031 0.752 . . . . 71.32 113.031 -167.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.583 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.5 t-20 -53.45 -54.02 42.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.171 0.442 . . . . 52.4 111.3 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -87.8 -0.48 57.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.44 110.461 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.737 ' O ' HG22 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -108.52 5.26 25.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.716 -0.674 . . . . 73.35 110.647 -172.767 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.91 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 2.6 m -54.85 -171.24 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 114.804 1.409 . . . . 73.14 114.804 -163.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.91 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 17.6 Cg_exo -7.07 82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.428 -2.334 0 C-N-CA 122.507 2.138 . . . . 54.3 113.828 -129.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.845 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -90.53 160.26 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 122.551 0.341 . . . . 63.41 111.327 -171.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.574 HD23 HG22 ' A' ' 12' ' ' VAL . 24.6 mt -97.46 103.03 14.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.281 0.562 . . . . 62.14 109.707 169.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 70.2 t80 -93.68 128.3 39.8 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.056 -0.975 . . . . 71.25 110.777 -177.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.409 ' HB1' ' CE1' ' A' ' 83' ' ' TYR . . . -78.13 102.82 7.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.027 -0.533 . . . . 72.42 110.273 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.535 ' CG2' HG23 ' A' ' 11' ' ' VAL . 61.7 t -66.47 146.5 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.729 -0.669 . . . . 63.22 110.874 -176.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 93.7 m-20 81.0 -31.67 0.11 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.176 0.99 . . . . 73.01 112.729 176.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -98.76 -9.57 24.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 121.17 -0.212 . . . . 74.4 111.505 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 27.8 t70 48.08 73.47 0.21 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.48 0.657 . . . . 73.34 111.642 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -160.26 148.75 16.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 35.42 110.095 -177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -95.95 127.62 42.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.294 -0.632 . . . . 74.41 109.294 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.09 -70.12 0.59 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.622 -0.511 . . . . 65.43 109.622 177.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 50.0 t 178.16 140.38 0.09 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.385 -0.825 . . . . 64.24 108.936 177.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 21' ' ' CYS . 6.8 t60 -144.07 130.82 20.22 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.099 -0.64 . . . . 65.02 110.951 170.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.468 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 2.1 m-85 174.59 -70.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 125.314 1.634 . . . . 74.0 107.718 173.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 41.0 m-85 -114.12 -74.52 0.62 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 73.54 110.118 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 18.0 tp 175.64 141.95 0.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.532 0.333 . . . . 71.42 110.162 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -95.21 -42.52 8.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.387 -0.369 . . . . 65.45 110.617 176.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 m 62.19 20.74 11.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.741 -0.663 . . . . 74.03 111.932 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -139.06 -53.27 0.57 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.615 -0.434 . . . . 70.24 111.092 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.08 -39.25 82.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 73.11 109.71 177.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.58 HD11 HD11 ' A' ' 10' ' ' LEU . 8.1 tp -66.85 -34.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.937 -0.574 . . . . 62.44 109.835 174.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.49 -37.72 94.03 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.63 -0.795 . . . . 73.34 111.242 177.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.22 81.28 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.437 -0.382 . . . . 64.41 110.759 174.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.409 ' CE1' ' HB1' ' A' ' 63' ' ' ALA . 63.7 t80 -67.66 -43.68 79.68 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.087 -0.506 . . . . 65.13 111.72 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -71.26 13.76 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.327 0.491 . . . . 73.33 112.327 -173.378 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.596 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 18.8 m . . . . . 0 C--N 1.322 -0.602 0 N-CA-C 109.775 -0.454 . . . . 74.23 109.775 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.683 -0.488 . . . . 75.41 109.683 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -76.15 157.97 37.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.661 2.241 . . . . 72.35 113.196 -167.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 83' ' ' TYR . 48.7 mtt180 -95.1 -172.02 2.57 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.511 -0.768 . . . . 72.44 109.334 175.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.6 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 87.5 tttt -145.58 140.64 27.55 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.335 0.588 . . . . 73.02 111.685 -177.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.546 HD11 ' CD1' ' A' ' 80' ' ' ILE . 61.5 mt -116.91 129.71 56.24 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.092 -0.958 . . . . 74.21 110.427 174.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -105.82 126.66 61.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 116.017 -0.538 . . . . 74.13 109.784 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.672 HG22 HD23 ' A' ' 61' ' ' LEU . 95.9 t -96.95 114.53 34.14 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.137 -0.483 . . . . 73.33 109.949 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.499 ' HB2' HG23 ' A' ' 60' ' ' VAL . 51.9 m-85 -91.9 122.72 34.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 72.41 110.533 177.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.75 166.03 26.33 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 109.818 -1.313 . . . . 62.42 109.818 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -83.44 -68.82 0.68 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 118.414 1.107 . . . . 54.15 110.093 -178.24 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.615 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . 1.8 mp0 -121.94 -77.24 0.59 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.2 -0.454 . . . . 44.11 110.114 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -154.04 154.91 25.83 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.389 -0.684 . . . . 52.33 111.389 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.8 t -162.5 145.66 11.32 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.843 -0.428 . . . . 51.12 109.843 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 32.8 m-70 -62.85 -36.19 82.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.696 -0.229 . . . . 65.14 111.215 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -32.39 72.61 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.861 0.363 . . . . 74.25 110.759 178.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 49.8 t -68.35 -42.1 79.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.217 -0.447 . . . . 60.55 109.8 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.37 -40.27 96.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.001 -0.545 . . . . 71.11 111.168 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.0 mm-40 -60.39 -47.06 87.73 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.109 0.481 . . . . 74.0 109.893 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.568 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.1 mtp -61.75 -49.66 75.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.732 -0.667 . . . . 74.44 111.373 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 75.0 mt -55.84 -45.63 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.854 -0.157 . . . . 71.32 111.4 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -37.15 78.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.986 0.422 . . . . 74.13 110.93 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.5 m -69.71 -38.4 76.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.61 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 24' ' ' MET . 82.3 mt -63.76 -39.29 93.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 53.52 110.828 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 1.0 OUTLIER -59.41 -38.29 80.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.097 0.475 . . . . 75.33 110.701 -179.237 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.96 -38.56 72.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.863 -0.608 . . . . 73.34 110.418 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -67.67 -32.65 73.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 74.32 111.438 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.5 mt-30 -59.63 -20.99 59.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.901 0.381 . . . . 63.34 111.432 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.73 -33.1 64.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 62.45 110.992 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.73 -38.64 11.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.171 0.51 . . . . 71.53 110.489 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.681 ' HB3' HD12 ' A' ' 84' ' ' LEU . 36.2 m -147.34 113.78 5.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.827 -0.624 . . . . 72.21 109.983 -177.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.84 128.54 33.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.025 0.441 . . . . 75.22 110.983 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.594 ' HB3' HD21 ' A' ' 84' ' ' LEU . 3.9 p90 -136.61 21.94 3.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.635 -0.711 . . . . 60.23 110.651 177.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.6 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 11.1 mm-40 58.51 -176.8 0.08 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.128 0.49 . . . . 64.05 110.576 -176.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.7 tp -152.62 109.84 3.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.4 -0.363 . . . . 72.14 110.197 170.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 42' ' ' ILE . 33.2 tt0 -121.31 118.73 30.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.046 -0.525 . . . . 63.23 109.593 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -106.9 112.31 39.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.612 -0.514 . . . . 64.43 109.612 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.414 HD11 ' OE2' ' A' ' 40' ' ' GLU . 65.9 mt -111.2 116.66 53.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.025 -0.534 . . . . 73.0 110.727 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.615 ' ND2' ' HA ' ' A' ' 16' ' ' GLU . 14.6 m120 -76.55 116.98 17.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.809 -0.632 . . . . 64.43 111.06 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 17.9 pt -77.04 -38.65 28.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.965 -0.561 . . . . 74.45 109.83 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.403 ' H ' ' HA ' ' A' ' 15' ' ' ARG . 37.1 t70 32.33 -96.42 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.575 1.172 . . . . 71.13 112.988 -177.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.74 34.79 3.63 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.861 -0.685 . . . . 35.15 112.469 -177.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.418 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 26.5 t-20 -85.18 116.81 23.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.584 -0.525 . . . . 72.14 109.584 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -57.01 -25.05 57.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.849 0.685 . . . . 55.21 112.849 -174.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.418 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 92.5 m-70 -77.8 -58.09 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.354 -0.538 . . . . 72.41 110.768 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.5 mt -78.78 -39.58 35.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.61 0.596 . . . . 64.01 112.61 -172.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.597 ' HA ' HD12 ' A' ' 44' ' ' ILE . 87.9 m -60.69 -48.76 80.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.834 0.35 . . . . 73.14 110.966 -178.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -64.43 -29.39 70.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.916 0.389 . . . . 71.15 110.912 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.5 mt -80.09 -50.67 10.01 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.386 0.513 . . . . 75.3 112.386 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -109.04 -1.87 18.58 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.328 1.233 . . . . 74.14 114.328 -165.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -73.19 89.25 1.51 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.916 0.78 . . . . 72.21 112.004 -175.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -136.75 -85.42 0.33 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.308 -0.86 . . . . 72.34 109.177 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -139.59 81.44 1.83 Allowed 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 105.761 -1.941 . . . . 75.55 105.761 171.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.515 HG23 ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -51.09 -84.86 0.0 OUTLIER Pre-proline 0 CA--C 1.507 -0.685 0 CA-C-N 114.435 -1.257 . . . . 63.51 114.365 -157.203 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.515 ' HD3' HG23 ' A' ' 58' ' ' VAL . 51.0 Cg_exo -21.08 78.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.569 0 C-N-CA 122.718 2.279 . . . . 64.01 114.223 -144.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -99.56 133.41 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.592 -0.731 . . . . 75.43 111.267 -170.374 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.672 HD23 HG22 ' A' ' 12' ' ' VAL . 58.1 mt -88.27 106.48 18.24 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.294 0.568 . . . . 72.13 109.694 170.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -91.31 121.97 33.52 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.309 -0.86 . . . . 74.24 109.868 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.5 100.89 6.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.85 -0.614 . . . . 34.32 110.465 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 52.8 t -67.89 161.57 3.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.315 -0.624 . . . . 75.44 109.315 177.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 32.1 m-80 79.68 -46.81 0.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.184 0.594 . . . . 74.23 111.618 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -94.3 -26.39 16.61 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.807 0.337 . . . . 73.53 110.258 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 60.99 82.21 0.17 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.316 -0.856 . . . . 72.51 111.791 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -165.11 166.41 19.13 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.261 -0.881 . . . . 72.24 110.112 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -94.17 127.98 40.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 72.44 110.393 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.4 mt -100.91 -82.19 0.46 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.537 0.684 . . . . 61.1 111.733 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 37.8 t -135.8 148.69 48.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.167 -0.924 . . . . 53.42 110.65 -169.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -145.2 163.19 35.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.74 -0.209 . . . . 75.14 111.236 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 82.85 -77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.616 0.969 . . . . 70.44 113.616 171.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -114.46 -0.35 13.78 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.737 0.643 . . . . 75.25 112.737 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.6 tp 66.93 108.27 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.673 . . . . 64.01 111.371 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -80.68 -21.8 40.99 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 54.12 110.8 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.7 m 70.82 -54.19 0.66 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.704 0.627 . . . . 75.2 111.809 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -60.39 -45.6 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.005 0.372 . . . . 63.41 112.005 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.13 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 75.44 111.977 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.839 HD11 HD23 ' A' ' 84' ' ' LEU . 5.5 tp -71.84 -34.53 51.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 C-N-CA 120.3 -0.56 . . . . 71.32 109.804 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.35 -35.25 90.69 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.649 -0.786 . . . . 45.13 111.731 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.32 72.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.984 0.421 . . . . 64.44 111.191 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.456 ' CZ ' ' HD3' ' A' ' 8' ' ' ARG . 20.2 t80 -87.76 -47.73 8.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.452 . . . . 71.21 111.712 178.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.839 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -69.46 -37.43 77.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.102 -0.499 . . . . 71.41 111.889 -171.396 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 110.487 -0.19 . . . . 75.31 110.487 -179.329 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 . . . . . 0 N--CA 1.445 -0.69 0 CA-C-O 120.828 0.347 . . . . 70.23 110.935 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.35 152.9 61.35 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.871 2.381 . . . . 62.33 113.282 -173.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' ' O ' ' A' ' 85' ' ' SER . 2.4 ptp180 -115.24 150.04 36.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.264 -0.88 . . . . 74.23 108.64 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.615 ' HG2' ' HG3' ' A' ' 38' ' ' GLU . 47.1 mtpt -100.38 135.96 41.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.643 0.609 . . . . 75.45 112.643 -172.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.714 HD11 HD11 ' A' ' 80' ' ' ILE . 73.5 mt -103.63 130.52 51.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.372 -0.831 . . . . 65.44 110.038 170.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -107.9 128.64 63.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.445 175.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.517 HG22 HD23 ' A' ' 61' ' ' LEU . 86.2 t -96.46 119.5 44.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 109.106 -0.701 . . . . 74.43 109.106 174.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB2' HG12 ' A' ' 60' ' ' VAL . 4.6 m-85 -78.47 97.02 5.55 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.015 0.436 . . . . 73.1 110.811 -179.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.542 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -80.44 160.62 43.98 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.81 -0.71 . . . . 72.31 112.539 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 1.011 ' HB2' HG11 ' A' ' 58' ' ' VAL . 34.9 ttp180 -144.94 -0.67 0.89 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.077 -0.712 . . . . 74.14 109.077 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 59.18 170.66 0.07 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 114.731 -1.122 . . . . 62.22 111.033 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.23 -56.94 4.88 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.808 -0.711 . . . . 52.13 113.632 175.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.17 113.47 6.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.085 0.469 . . . . 73.22 110.97 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -71.46 -28.29 63.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.871 -0.604 . . . . 74.41 111.198 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 73' ' ' TYR . 18.6 mt -54.4 -30.19 51.36 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.624 0.231 . . . . 75.22 111.624 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.417 ' O ' HG13 ' A' ' 25' ' ' ILE . 71.0 m -56.08 -38.74 71.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.671 0.272 . . . . 71.42 110.731 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -71.29 -33.46 69.75 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.731 0.3 . . . . 75.23 110.629 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LEU . 8.3 mm-40 -56.24 -45.05 80.17 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.081 -0.509 . . . . 71.33 110.077 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.616 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.7 mmm -67.0 -41.47 86.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.517 -0.765 . . . . 43.25 110.137 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 21' ' ' CYS . 79.1 mt -56.82 -45.26 83.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 115.938 -0.573 . . . . 71.05 110.805 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.45 87.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.903 0.382 . . . . 75.11 110.69 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -61.59 -42.86 99.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 54.2 110.958 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 24' ' ' MET . 73.8 mt -64.06 -37.6 88.04 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.209 -0.45 . . . . 72.41 110.915 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -61.24 -42.4 98.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.254 -0.43 . . . . 75.03 110.893 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.567 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 97.9 t -71.61 -39.43 69.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.622 178.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HA ' HD23 ' A' ' 31' ' ' LEU . 14.2 mt -66.71 -34.79 78.62 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.377 -0.374 . . . . 72.21 111.443 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.555 HE22 ' HB2' ' A' ' 39' ' ' LEU . 24.4 mt-30 -59.87 -20.99 60.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 72.43 111.37 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.9 mtmt -82.02 -15.86 52.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.04 111.191 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -106.43 -46.2 4.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.481 0.658 . . . . 71.33 109.743 178.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.9 m -141.19 113.22 7.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.884 -1.053 . . . . 72.15 109.319 -175.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -79.22 129.22 34.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.989 0.423 . . . . 64.52 111.7 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' A' ' 84' ' ' LEU . 3.1 p90 -138.27 18.42 2.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.997 -0.547 . . . . 74.4 111.282 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.615 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 12.0 mm-40 57.84 -178.55 0.06 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.329 0.585 . . . . 73.11 111.159 -176.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.555 ' HB2' HE22 ' A' ' 32' ' ' GLN . 5.8 tp -150.7 117.3 5.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.053 -0.521 . . . . 74.22 110.36 171.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB3' HG22 ' A' ' 11' ' ' VAL . 29.7 tt0 -126.47 123.51 38.0 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.557 -0.747 . . . . 71.25 109.568 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.1 t -104.74 120.25 54.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.472 -0.331 . . . . 43.3 110.153 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 11' ' ' VAL . 75.7 mt -124.71 110.41 24.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.381 -0.372 . . . . 62.52 110.333 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.2 m120 -69.62 122.81 19.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.265 0.555 . . . . 75.23 111.829 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.584 HD13 ' HB2' ' A' ' 54' ' ' TYR . 44.8 pt -86.57 -10.05 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.856 -0.611 . . . . 61.41 110.445 178.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.436 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 5.6 p-10 -73.53 -7.12 50.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.014 0.435 . . . . 74.23 110.32 177.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.36 -2.95 58.83 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.156 -0.778 . . . . 74.33 111.156 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -131.59 97.52 4.25 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.426 -0.583 . . . . 63.11 109.426 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.92 -24.67 67.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.307 0.855 . . . . 54.34 113.307 -169.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -75.27 -41.67 56.73 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.231 -0.588 . . . . 64.12 110.171 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.91 -31.5 72.7 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.51 -0.313 . . . . 75.5 110.594 173.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.479 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 45.5 m -53.43 -57.16 11.62 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.069 -0.514 . . . . 53.45 111.326 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.0 mtt-85 -63.93 -31.28 72.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.025 0.44 . . . . 65.32 111.62 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.7 mt -68.11 -39.86 82.69 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.333 0.494 . . . . 70.43 112.333 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.584 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.5 m-85 -131.47 19.34 4.77 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 112.44 0.533 . . . . 75.42 112.44 -172.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 51' ' ' THR . 45.2 t30 -52.13 -53.35 43.8 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.051 0.453 . . . . 74.41 111.846 -176.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -93.25 11.88 26.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.749 -0.659 . . . . 72.5 110.365 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.724 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 72.7 mtm180 -135.49 50.82 2.1 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.773 -0.825 . . . . 75.33 108.773 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.011 HG11 ' HB2' ' A' ' 15' ' ' ARG . 1.4 m -89.27 -24.28 0.29 Allowed Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 114.078 1.14 . . . . 75.15 114.078 -178.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.905 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 8.3 Cg_exo -75.08 52.02 2.97 Favored 'Trans proline' 0 N--CA 1.44 -1.64 0 CA-C-N 121.025 1.402 . . . . 74.01 110.039 165.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.4 OUTLIER -111.46 150.53 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 CA-C-N 114.893 -1.049 . . . . 73.33 110.141 -171.048 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 70' ' ' LEU . 91.6 mt -113.28 122.14 46.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.896 0.379 . . . . 63.03 111.18 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.552 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 91.2 t80 -99.61 125.26 45.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.965 -0.561 . . . . 73.51 109.931 175.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.644 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . . . -84.88 106.95 16.78 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.895 0.379 . . . . 74.41 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.3 t -78.89 93.83 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.04 -0.527 . . . . 65.24 110.093 177.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 33.9 t-20 170.89 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 72.43 109.206 -177.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -119.64 -11.63 9.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.596 -0.729 . . . . 74.12 111.026 -176.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 66.69 89.57 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.429 0.633 . . . . 75.44 109.725 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 63' ' ' ALA . 19.3 ptmt -167.9 150.57 5.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 72.54 109.913 -175.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.76 135.41 34.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.753 -0.462 . . . . 64.23 109.753 175.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 3.1 mm? -79.14 -70.99 0.47 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.779 -0.646 . . . . 53.15 110.496 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.492 ' SG ' HD12 ' A' ' 75' ' ' LEU . 8.4 p -152.97 -178.91 7.21 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.388 -0.824 . . . . 71.43 110.101 -178.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -118.38 -170.93 1.98 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.851 -0.613 . . . . 53.43 110.242 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.905 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 21.1 p90 -41.9 135.16 2.43 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 123.769 0.668 . . . . 74.52 111.378 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.486 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 56.6 m-85 71.87 94.13 0.08 Allowed 'General case' 0 C--O 1.231 0.127 0 O-C-N 124.119 0.887 . . . . 73.3 109.353 -173.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.492 HD12 ' SG ' ' A' ' 71' ' ' CYS . 38.4 tp -53.58 123.86 13.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.07 -1.423 . . . . 72.33 113.849 -166.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 71' ' ' CYS . 4.4 m-20 -80.9 94.24 6.45 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.081 -1.081 . . . . 72.11 108.081 167.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.1 m -67.85 -36.43 80.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 72.52 111.515 -169.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.55 -43.46 98.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.341 . . . . 54.32 111.228 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.2 -46.92 86.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.159 -0.473 . . . . 62.03 111.598 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.714 HD11 HD11 ' A' ' 10' ' ' LEU . 7.8 tp -66.93 -37.22 78.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.034 -0.666 . . . . 71.42 110.431 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.85 -37.2 93.31 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.578 -0.82 . . . . 53.52 111.661 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -47.46 83.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.879 0.371 . . . . 75.24 110.843 177.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -72.6 -34.25 67.27 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.002 -0.545 . . . . 74.52 111.767 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -84.41 11.05 9.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.409 -0.359 . . . . 75.45 111.859 -174.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.774 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.162 -0.681 . . . . 65.43 109.162 172.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.7 pt-20 . . . . . 0 CA--C 1.535 0.373 0 N-CA-C 109.324 -0.621 . . . . 74.3 109.324 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 74.4 Cg_endo -73.8 154.51 48.73 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.057 1.838 . . . . 60.43 113.153 -174.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.899 ' NH1' ' O ' ' A' ' 85' ' ' SER . 9.5 ptp180 -109.54 116.22 31.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.746 -0.661 . . . . 73.15 109.602 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 82.7 tttt -74.78 140.12 43.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.877 0.695 . . . . 74.21 112.877 -168.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.694 HD11 HD11 ' A' ' 80' ' ' ILE . 32.8 mt -113.08 145.89 40.12 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.203 -0.908 . . . . 74.34 110.736 172.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.9 t -119.73 138.53 50.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.004 -0.544 . . . . 71.31 109.937 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.651 HG22 HD23 ' A' ' 61' ' ' LEU . 65.9 t -113.57 119.97 62.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 N-CA-C 110.165 -0.309 . . . . 74.43 110.165 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 1.024 ' HB2' HG23 ' A' ' 60' ' ' VAL . 63.8 m-85 -83.64 113.87 21.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.526 -0.546 . . . . 75.31 109.526 174.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -124.01 -173.74 13.97 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.617 -0.593 . . . . 74.22 111.617 -177.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' HB2' ' A' ' 45' ' ' ASP . 6.2 ptm85 -159.2 154.89 26.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.821 0.343 . . . . 74.31 110.715 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -73.44 72.62 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.541 -0.754 . . . . 71.12 109.686 174.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.56 61.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.672 -0.695 . . . . 73.45 111.926 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.4 t -172.06 114.37 0.33 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.889 -0.782 . . . . 50.25 108.889 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -70.99 -35.46 72.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.345 -0.389 . . . . 65.14 111.826 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -52.95 -29.2 27.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.929 0.714 . . . . 63.25 112.929 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 62.6 m -54.99 -32.93 62.12 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.623 0.249 . . . . 73.02 111.045 178.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -64.15 -50.34 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.381 -0.372 . . . . 63.24 110.401 178.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -55.12 -49.44 71.75 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.518 -0.764 . . . . 54.15 111.241 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.549 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 63.7 mtp -59.09 -54.28 48.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 71.11 111.115 -179.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.69 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 84.1 mt -56.12 -50.59 69.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 73.52 111.407 -177.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -37.81 73.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.958 0.409 . . . . 72.42 111.142 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.4 m -69.11 -43.48 74.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 65.54 110.879 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 24' ' ' MET . 80.4 mt -65.38 -38.38 89.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.03 111.424 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 11.5 mmm180 -58.07 -35.65 71.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 71.34 111.01 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.7 t -77.32 -32.71 19.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.328 -0.396 . . . . 74.44 110.608 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -30.68 66.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.037 0.446 . . . . 75.23 109.859 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.6 mt-30 -59.93 -20.83 59.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.88 -0.6 . . . . 71.41 111.252 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -81.21 -15.54 55.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 63.12 110.855 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -96.97 -49.29 5.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.319 -0.623 . . . . 65.32 109.319 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 17.9 m -140.88 119.8 12.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.025 -0.989 . . . . 72.34 109.366 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -79.26 131.68 36.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.039 0.447 . . . . 74.44 110.618 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' HD12 ' A' ' 10' ' ' LEU . 9.1 p90 -139.15 16.58 2.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.806 -0.634 . . . . 73.4 111.582 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.501 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 15.6 mm-40 59.94 178.5 0.09 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.991 0.424 . . . . 72.24 110.611 -176.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.9 tp -153.19 110.12 3.45 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 120.264 -0.574 . . . . 72.43 110.88 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -115.87 118.63 33.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.97 -0.559 . . . . 72.42 109.97 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -105.4 113.84 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 110.085 -0.339 . . . . 40.11 110.085 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.7 mt -113.05 114.85 48.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.148 -0.478 . . . . 74.44 110.869 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -73.04 118.24 15.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.659 -0.701 . . . . 72.53 111.509 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.524 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.9 pt -86.11 -25.27 6.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.07 -0.514 . . . . 73.33 111.804 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 32.9 t70 -67.49 -23.51 65.49 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.978 0.418 . . . . 73.31 111.55 -172.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.89 19.38 30.11 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.993 -0.622 . . . . 74.24 111.828 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -142.27 119.39 11.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.378 -0.601 . . . . 54.22 109.378 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -55.52 -37.52 68.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 62.42 111.26 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.51 -52.75 9.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.158 -0.473 . . . . 65.13 110.966 -174.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.428 HD23 HD12 ' A' ' 53' ' ' LEU . 48.4 mt -64.11 -33.73 76.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.519 -0.31 . . . . 61.22 111.573 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.57 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 88.1 m -57.85 -53.21 60.77 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 120.845 0.355 . . . . 64.54 110.368 175.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.88 -31.48 72.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.27 -0.423 . . . . 74.31 111.402 -178.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 50' ' ' LEU . 72.1 mt -71.55 -48.35 49.08 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.381 0.512 . . . . 54.5 112.381 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.555 ' CD2' HG21 ' A' ' 60' ' ' VAL . 89.6 m-85 -113.94 8.59 17.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.28 0.844 . . . . 75.32 113.28 -169.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.57 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.2 t30 -59.66 135.86 57.81 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.398 -0.521 . . . . 75.04 111.478 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.3 t70 74.86 -30.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 71.44 112.903 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.494 ' HG2' ' OH ' ' A' ' 73' ' ' TYR . 82.8 mtt180 -116.03 37.24 3.73 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 108.364 -0.976 . . . . 75.15 108.364 -175.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.604 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.67 -97.57 0.0 OUTLIER Pre-proline 0 N--CA 1.425 -1.717 0 CA-C-N 115.276 -0.875 . . . . 74.5 110.228 -176.228 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.604 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 65.8 Cg_exo -17.74 75.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 122.535 2.157 . . . . 61.25 113.288 -146.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 1.024 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -111.3 126.16 68.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.916 -1.038 . . . . 70.42 111.699 -165.546 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.651 HD23 HG22 ' A' ' 12' ' ' VAL . 21.5 mt -89.62 112.87 24.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.882 -0.599 . . . . 75.21 110.72 176.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.592 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.0 t80 -91.79 120.28 32.37 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.522 -0.763 . . . . 71.52 109.761 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.87 102.82 11.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.945 -0.57 . . . . 50.32 110.196 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 50.0 t -63.94 146.83 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.145 -0.687 . . . . 64.34 109.145 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 49.8 m-80 85.18 -29.06 0.08 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.157 0.983 . . . . 70.32 111.047 -177.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.699 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 28.0 mt-10 -96.7 -37.01 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.26 -0.176 . . . . 74.51 111.236 176.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.592 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 18.2 t70 68.93 77.77 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.791 0.682 . . . . 75.35 109.896 -176.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.699 ' HD3' ' HB3' ' A' ' 66' ' ' GLU . 16.4 ptmt -179.77 157.82 0.75 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.36 -0.837 . . . . 73.14 109.674 -174.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mp0 -94.9 141.19 28.93 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.566 -0.531 . . . . 73.15 109.566 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 63.4 mt -84.07 -66.16 0.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.447 0.642 . . . . 74.21 110.036 176.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 19.3 t -144.29 170.76 15.39 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.865 -0.791 . . . . 74.51 108.865 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.546 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 1.5 p-80 -144.36 174.65 10.73 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 123.006 0.191 . . . . 62.52 111.503 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.494 ' OH ' ' HG2' ' A' ' 57' ' ' ARG . 18.2 m-85 80.05 -81.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.173 0.989 . . . . 74.25 112.256 178.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.549 ' O ' ' HG2' ' A' ' 24' ' ' MET . 56.0 m-85 -112.37 -84.5 0.58 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 121.023 -0.271 . . . . 62.33 110.846 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.4 tp 178.35 147.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.126 -0.488 . . . . 62.22 110.016 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.525 ' O ' HG22 ' A' ' 80' ' ' ILE . 18.6 t70 -141.12 109.74 5.99 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.498 -0.556 . . . . 73.44 109.498 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 -27.88 69.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.829 -0.623 . . . . 72.43 111.659 -174.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -73.84 -49.53 24.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.967 -0.56 . . . . 65.24 111.446 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.21 -46.97 89.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 45.32 111.796 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.694 HD11 HD11 ' A' ' 10' ' ' LEU . 7.0 tp -69.42 -30.5 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.856 -0.737 . . . . 53.21 109.985 177.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.59 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . -65.42 -19.97 67.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.047 -0.597 . . . . 53.22 111.8 176.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.79 -35.21 60.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.127 0.489 . . . . 63.45 110.231 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -86.53 -40.12 15.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 73.41 111.057 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.595 HD23 HD11 ' A' ' 80' ' ' ILE . 1.7 mm? -85.74 13.51 7.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.4 -0.363 . . . . 71.14 111.404 -178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.899 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 4.4 t . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.502 -0.555 . . . . 75.31 109.502 176.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.448 -0.573 0 N-CA-C 109.911 -0.403 . . . . 74.23 109.911 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.99 121.28 4.43 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.632 2.221 . . . . 62.34 112.477 -175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -102.99 119.08 38.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.426 -0.806 . . . . 70.53 109.741 177.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 57.6 mtpt -73.03 139.0 46.29 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.992 -0.549 . . . . 74.02 112.239 -172.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.597 HD11 HD11 ' A' ' 80' ' ' ILE . 22.3 mt -105.77 119.12 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.286 -0.87 . . . . 72.12 109.923 170.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 40' ' ' GLU . 80.9 t -102.07 129.89 52.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.868 -0.605 . . . . 43.15 109.982 177.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.531 HG22 ' CD2' ' A' ' 61' ' ' LEU . 46.3 t -96.33 107.06 19.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 116.068 -0.515 . . . . 61.33 109.731 176.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 1.069 ' HB2' HG23 ' A' ' 60' ' ' VAL . 20.2 m-85 -81.48 116.89 21.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.396 -0.594 . . . . 63.32 109.396 174.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -147.93 -151.8 5.53 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.286 -0.726 . . . . 62.43 111.286 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.415 ' HE ' ' HB2' ' A' ' 15' ' ' ARG . 5.4 ptm180 -171.26 164.64 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.96 0.41 . . . . 73.4 110.743 176.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.13 131.09 48.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.531 -0.759 . . . . 74.41 110.704 175.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.81 -7.55 55.44 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 23.13 112.863 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -104.53 102.87 12.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.123 0.487 . . . . 73.12 109.827 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -64.61 -33.11 75.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.717 -0.674 . . . . 74.32 110.634 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -59.31 -31.57 69.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.389 -0.369 . . . . 71.32 111.56 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.471 ' O ' HG13 ' A' ' 25' ' ' ILE . 68.3 m -61.04 -42.04 97.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.977 0.418 . . . . 62.54 110.32 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -70.53 -35.13 72.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.02 -0.536 . . . . 63.33 110.47 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.49 -34.34 77.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.733 -0.667 . . . . 73.12 110.686 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.1 mtt -64.54 -43.97 92.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.098 -0.501 . . . . 72.31 110.893 173.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.6 mt -54.68 -53.25 33.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.315 -0.402 . . . . 75.54 110.92 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.18 -31.07 68.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.444 -0.344 . . . . 74.1 111.416 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.7 m -73.33 -46.24 50.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.216 -0.447 . . . . 72.11 110.721 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.478 HD11 HD11 ' A' ' 61' ' ' LEU . 9.2 mp -64.94 -35.91 82.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.197 -0.456 . . . . 75.03 111.604 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -56.61 -34.06 66.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.013 0.435 . . . . 75.32 111.257 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.59 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.7 t -76.79 -40.23 31.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.086 -0.506 . . . . 73.23 110.748 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.423 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -62.81 -34.71 77.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.525 -0.307 . . . . 75.04 111.024 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -53.93 -29.34 41.86 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.49 0.494 . . . . 72.11 111.444 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 54.7 mtmt -77.23 -11.76 59.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.888 -0.596 . . . . 75.34 111.391 -176.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -108.81 -45.84 3.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.527 0.68 . . . . 71.1 109.496 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.562 ' HB3' HD12 ' A' ' 84' ' ' LEU . 44.4 m -137.39 124.08 21.08 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.02 -0.991 . . . . 74.42 109.629 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -84.23 134.25 34.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.065 0.459 . . . . 75.43 111.597 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 9.5 p90 -147.79 18.23 1.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.769 -0.651 . . . . 71.52 110.957 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 27.2 mm-40 58.53 -169.26 0.13 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.561 -0.29 . . . . 72.44 110.468 -177.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.62 131.03 13.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.796 -0.446 . . . . 61.12 109.796 175.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.603 ' HB3' HG22 ' A' ' 11' ' ' VAL . 5.1 tt0 -146.36 128.23 15.4 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.565 -0.532 . . . . 72.33 109.565 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.2 t -118.9 119.39 60.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.892 -0.41 . . . . 71.34 109.892 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.448 HD12 HG11 ' A' ' 11' ' ' VAL . 71.3 mt -127.7 126.15 66.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.466 -0.334 . . . . 74.03 110.971 -174.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 94.8 m-20 -76.98 126.95 31.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.591 . . . . 71.4 111.094 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' CG1' ' A' ' 58' ' ' VAL . 2.7 pp -79.06 -23.64 12.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 74.52 111.52 -178.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -79.17 -5.48 54.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 72.21 111.067 -175.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.69 -6.58 63.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.791 -0.719 . . . . 71.04 111.762 174.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -127.19 123.92 37.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.653 0.263 . . . . 75.45 110.85 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -50.92 -47.37 60.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 71.22 111.492 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -61.12 -48.88 79.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.386 . . . . 75.5 110.818 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.0 mt -73.23 -31.38 64.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.964 -0.562 . . . . 63.35 111.694 -172.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 55' ' ' ASN . 31.1 m -61.26 -51.69 67.89 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 121.16 0.505 . . . . 73.34 110.334 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -61.11 -30.74 70.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.916 -0.584 . . . . 71.22 111.112 -177.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.77 -34.27 24.82 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.034 0.753 . . . . 72.52 113.034 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -135.85 10.97 3.38 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.443 -0.503 . . . . 70.33 112.283 -165.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 51' ' ' THR . 2.7 p-10 -46.07 -39.09 8.81 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.251 0.834 . . . . 70.12 113.251 -172.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -131.0 21.6 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.641 0.734 . . . . 72.44 110.932 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.1 ttm180 -146.17 44.4 1.24 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.528 -1.286 . . . . 71.13 107.528 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.572 ' CG1' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.2 -98.1 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.52 0 CA-C-N 115.199 -0.91 . . . . 54.21 111.275 -171.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.705 ' O ' ' HA ' ' A' ' 72' ' ' HIS . 73.0 Cg_exo -20.17 76.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.29 0 C-N-CA 122.504 2.136 . . . . 74.15 113.646 -145.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 1.069 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -110.42 121.28 62.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 115.24 -0.891 . . . . 65.3 111.179 -170.521 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.531 ' CD2' HG22 ' A' ' 12' ' ' VAL . 38.9 mt -83.25 107.55 15.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.15 -0.477 . . . . 71.2 110.742 176.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -92.33 122.54 34.89 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.829 -0.623 . . . . 64.25 110.418 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.08 102.35 10.96 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.728 -0.669 . . . . 61.42 111.208 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 9' ' ' LYS . 29.4 t -81.15 87.29 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.306 0.574 . . . . 54.03 110.184 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 23.5 t-20 172.32 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.764 -1.107 . . . . 75.12 108.233 -179.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -99.15 -19.54 17.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.879 -1.055 . . . . 75.13 109.862 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.7 t70 67.37 78.41 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.122 -0.945 . . . . 72.12 111.029 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.98 149.32 0.9 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.042 -0.526 . . . . 73.53 110.445 174.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.57 140.09 34.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.941 -0.572 . . . . 73.13 110.415 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -91.6 -81.63 0.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.02 0.438 . . . . 75.32 110.838 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.4 p -122.82 164.45 18.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.113 -0.494 . . . . 43.34 109.85 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.705 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.4 p-80 -144.83 168.03 21.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.43 0.53 . . . . 54.41 112.43 -176.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 26.2 m-85 74.74 -82.5 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.241 1.016 . . . . 72.35 112.231 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 22.9 m-85 -99.48 -79.51 0.49 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.77 -0.372 . . . . 75.14 110.512 -176.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 22.2 tp 171.21 147.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.888 0.743 . . . . 54.35 109.716 176.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -123.68 115.37 21.32 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.675 -0.861 . . . . 71.31 108.675 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.7 p -82.04 -2.63 52.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.981 -0.554 . . . . 74.22 112.364 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -107.43 -39.45 5.64 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.94 -0.304 . . . . 72.21 111.092 -176.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.72 -45.04 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.601 -0.272 . . . . 60.5 110.69 176.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.597 HD11 HD11 ' A' ' 10' ' ' LEU . 7.3 tp -68.34 -31.47 51.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.532 -0.467 . . . . 54.22 110.09 176.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.12 -34.51 86.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.646 -0.788 . . . . 62.44 111.704 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.95 -36.7 72.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.987 0.422 . . . . 62.23 110.492 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -81.34 -47.25 13.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.898 -0.592 . . . . 63.2 111.837 -177.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.562 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.3 OUTLIER -79.11 13.41 1.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.08 0.4 . . . . 71.21 112.08 -172.045 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.765 -0.457 . . . . 65.14 109.765 176.536 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.675 0.274 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -109.71 156.27 20.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.831 0.348 . . . . 0.0 110.285 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -171.58 114.49 0.37 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -63.9 145.75 55.26 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 29.2 m -81.58 176.54 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.932 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -77.04 145.98 74.53 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.01 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -81.39 173.95 11.09 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.786 2.324 . . . . 0.0 113.044 -171.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -103.75 140.47 37.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.562 ' HD3' ' HB2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -86.66 146.96 26.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 110.081 -0.341 . . . . 0.0 110.081 -176.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 61' ' ' LEU . 96.3 mt -122.16 137.65 54.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.355 0.598 . . . . 0.0 111.216 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.531 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -119.35 139.62 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.144 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 53.0 t -110.89 114.01 45.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 120.923 0.392 . . . . 0.0 110.133 175.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.761 ' HB2' HG23 ' A' ' 60' ' ' VAL . 71.5 m-85 -82.31 132.57 35.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.165 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.61 -163.58 13.56 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -157.47 121.37 4.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.186 -0.302 . . . . 0.0 110.186 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 61.93 -171.39 0.16 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.475 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.16 98.14 2.21 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.23 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.448 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 38.8 t -108.1 142.36 38.41 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 177.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 3.4 m170 -60.28 -44.44 95.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 73' ' ' TYR . 45.0 mt -58.43 -35.18 71.7 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.157 -0.217 . . . . 0.0 111.184 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.505 ' O ' HG13 ' A' ' 25' ' ' ILE . 77.9 m -62.51 -49.99 73.17 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 175.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -59.65 -44.11 93.67 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.326 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.3 mm-40 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.684 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.413 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.1 mtp -69.09 -37.95 78.7 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.918 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 21' ' ' CYS . 71.5 mt -56.91 -48.92 80.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 175.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -59.53 -41.17 89.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.651 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.7 m -61.42 -46.7 89.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.899 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.486 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 93.2 mt -72.61 -31.31 65.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.381 -177.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -63.61 -39.02 93.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.921 0.391 . . . . 0.0 110.393 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.421 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 91.7 t -65.95 -44.9 92.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.31 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' A' ' 31' ' ' LEU . 11.9 mt -62.73 -35.6 80.27 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.527 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.697 HE22 ' HB2' ' A' ' 39' ' ' LEU . 40.0 mt-30 -58.68 -21.38 54.27 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -74.69 -30.91 61.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.026 0.441 . . . . 0.0 110.738 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.7 mttm -91.17 -46.52 8.05 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.095 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.602 ' HB3' HD12 ' A' ' 84' ' ' LEU . 23.2 m -138.5 115.86 11.17 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.66 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.7 t-105 -78.59 131.9 36.92 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.538 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.523 ' HB2' ' HG ' ' A' ' 10' ' ' LEU . 3.6 p90 -145.46 13.8 1.39 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.562 ' HB2' ' HD3' ' A' ' 9' ' ' LYS . 15.7 mt-10 57.64 179.86 0.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.516 -175.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.697 ' HB2' HE22 ' A' ' 32' ' ' GLN . 8.3 tp -152.02 114.74 4.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.827 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.531 ' HB3' HG22 ' A' ' 11' ' ' VAL . 13.2 tt0 -129.64 120.34 25.06 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.309 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.3 116.86 45.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.954 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.419 HD12 HG11 ' A' ' 11' ' ' VAL . 68.5 mt -114.22 130.15 68.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.041 -175.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -74.98 119.53 19.28 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.623 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.532 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.6 pt -88.12 -15.52 9.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.118 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -54.81 -37.26 65.87 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.372 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.94 -51.12 15.72 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.978 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -82.01 93.81 7.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.018 0.437 . . . . 0.0 110.739 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.91 -18.94 65.67 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.257 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -62.56 -43.42 98.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 171.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.71 -36.93 73.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.296 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.532 ' HA ' HD12 ' A' ' 44' ' ' ILE . 92.0 m -64.35 -34.85 79.1 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.582 176.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.3 -35.71 81.74 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.157 0.503 . . . . 0.0 109.866 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.61 -51.02 21.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.399 178.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -108.65 -64.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.888 -170.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 51' ' ' THR . 7.2 t30 55.37 -85.37 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.349 0.66 . . . . 0.0 112.152 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -84.07 -29.27 26.98 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.74 -174.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HD2' ' N ' ' A' ' 57' ' ' ARG . 1.1 mpt_? -95.26 66.87 2.94 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.694 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -85.73 -122.71 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.632 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.751 179.059 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.694 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 88.3 Cg_exo -10.33 66.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.449 2.1 . . . . 0.0 113.409 -142.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.761 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.71 127.0 44.28 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.526 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.971 -167.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.601 HD11 HD13 ' A' ' 10' ' ' LEU . 2.4 tm? -91.17 103.7 16.35 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.385 -177.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.492 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 79.2 t80 -95.57 136.89 35.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.754 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.54 109.3 20.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 21.4 t -85.72 153.69 3.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 2.6 m-20 71.71 22.09 4.1 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -173.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -157.44 -39.38 0.07 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.944 -1.026 . . . . 0.0 109.072 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 69.96 60.15 0.26 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.245 172.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.58 158.67 37.52 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.022 176.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -82.93 139.09 33.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.0 mt -105.23 -64.52 1.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.444 0.64 . . . . 0.0 110.09 176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 71.0 m -132.14 -177.11 4.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.333 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.612 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 10.9 p80 -144.41 -170.32 3.34 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.784 ' HB2' HD13 ' A' ' 20' ' ' LEU . 15.3 p90 -39.67 134.05 1.4 Allowed 'General case' 0 C--O 1.238 0.492 0 O-C-N 124.081 0.863 . . . . 0.0 111.073 175.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.49 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 88.1 m-85 73.31 95.76 0.07 Allowed 'General case' 0 N--CA 1.464 0.229 0 O-C-N 124.474 1.109 . . . . 0.0 109.426 -171.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.5 tp -60.31 128.6 37.51 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.443 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -78.84 -32.71 46.22 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 43.1 m 69.98 -51.25 0.64 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.281 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -56.38 -48.04 77.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.986 0.422 . . . . 0.0 111.574 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 33.8 t -64.25 -51.67 65.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.369 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.97 -25.87 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.513 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.647 ' O ' ' O ' ' A' ' 85' ' ' SER . . . -64.35 -44.69 95.05 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.417 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.94 -24.49 65.19 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.241 0.544 . . . . 0.0 110.818 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -87.9 -57.05 3.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.163 -176.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -71.94 -39.79 69.18 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.7 -170.506 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.647 ' O ' ' O ' ' A' ' 81' ' ' GLY . 32.6 t . . . . . 0 C--N 1.324 -0.524 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -174.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.762 -0.458 . . . . 74.44 109.762 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -93.24 99.77 12.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.052 0.454 . . . . 62.42 111.487 -174.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -104.44 63.27 0.73 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.661 -0.699 . . . . 72.22 109.435 173.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -95.03 -176.61 3.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.069 -0.514 . . . . 74.31 110.67 -177.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -113.9 163.3 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.342 0.592 . . . . 64.45 111.394 -175.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.565 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 11.7 pt-20 -76.61 165.86 49.34 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 114.874 -1.057 . . . . 72.51 110.141 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.1 Cg_endo -73.07 143.42 36.05 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.107 1.871 . . . . 72.33 111.839 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 1.001 ' NH1' ' O ' ' A' ' 85' ' ' SER . 10.8 ptp180 -97.73 171.39 8.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.761 -0.654 . . . . 65.23 109.751 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.573 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.4 tttt -135.79 152.78 51.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.048 0.452 . . . . 75.31 111.748 -174.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.642 HD13 HD11 ' A' ' 61' ' ' LEU . 95.4 mt -122.58 147.52 46.3 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.38 -0.827 . . . . 72.5 110.838 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' A' ' 64' ' ' VAL . 78.0 t -122.91 133.56 68.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.864 -0.607 . . . . 70.22 110.17 175.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 61' ' ' LEU . 72.6 t -105.37 114.32 44.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 120.941 0.4 . . . . 65.15 110.304 175.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -90.11 117.88 29.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.937 -0.574 . . . . 75.32 110.074 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.28 163.91 26.66 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.271 -0.966 . . . . 74.15 112.56 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.998 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.3 ptm180 -150.29 114.31 5.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.252 -0.277 . . . . 53.13 110.252 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.68 17.93 4.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.715 -0.675 . . . . 71.04 112.549 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -103.58 64.92 0.36 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.071 -0.585 . . . . 61.3 111.76 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 46.1 t -60.16 -47.68 84.91 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.437 0.295 . . . . 21.41 111.478 -175.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.565 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 16.9 t-160 -68.54 -47.25 67.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.519 -0.31 . . . . 71.11 110.546 -175.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -63.12 -36.08 82.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.323 -0.399 . . . . 70.31 111.001 -179.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.72 -47.8 82.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 63.3 110.14 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 27.5 mm-40 -56.88 -43.88 81.72 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.151 -0.477 . . . . 62.15 111.297 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 7.9 mm-40 -62.96 -48.18 79.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.882 -0.599 . . . . 74.33 110.989 -177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 81.3 mtp -67.46 -38.69 84.83 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.872 -0.331 . . . . 72.21 111.153 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 44.4 mt -57.46 -44.48 84.76 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.516 -0.179 . . . . 72.22 110.516 178.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.12 -43.34 82.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.891 0.377 . . . . 73.01 110.683 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 69.6 m -63.21 -43.33 98.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.051 177.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' MET . 92.7 mt -69.72 -34.36 73.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.932 -0.576 . . . . 74.12 111.112 -178.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 24.2 mmm-85 -60.67 -38.94 86.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.06 0.457 . . . . 74.45 110.576 177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.585 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.1 t -70.13 -43.83 78.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.853 -0.612 . . . . 73.42 110.638 177.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.54 -33.23 74.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.378 -0.374 . . . . 62.4 110.741 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -59.93 -23.92 63.92 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.746 0.308 . . . . 64.44 111.529 176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.1 mtmt -76.68 -17.69 58.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.103 0.478 . . . . 51.31 110.996 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -103.69 -43.14 5.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.699 -0.682 . . . . 72.2 110.423 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.563 ' HB3' HD12 ' A' ' 84' ' ' LEU . 20.0 m -142.94 119.88 11.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.217 -0.901 . . . . 43.42 109.452 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -78.22 131.77 37.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.345 . . . . 75.34 110.913 -177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.605 ' CD1' HD12 ' A' ' 10' ' ' LEU . 6.7 p90 -144.82 16.66 1.6 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.905 -0.588 . . . . 75.04 111.482 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 36.8 mm-40 58.58 -175.32 0.09 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.207 0.527 . . . . 73.32 110.974 -177.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.7 tp -151.58 110.71 3.9 Favored 'General case' 0 C--N 1.317 -0.833 0 O-C-N 122.001 -0.437 . . . . 62.32 110.692 172.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 11' ' ' VAL . 9.4 tp10 -104.62 141.16 36.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.043 -0.526 . . . . 74.04 109.912 176.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.4 t -127.89 117.29 45.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.454 -0.573 . . . . 71.01 109.454 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.4 mt -128.65 110.62 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.429 . . . . 60.45 111.657 -176.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.4 m120 -68.54 107.41 2.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.896 -0.593 . . . . 54.11 110.007 171.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.433 ' CD1' ' HB2' ' A' ' 54' ' ' TYR . 44.5 pt -82.79 -7.52 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.09 -0.505 . . . . 70.33 111.089 -177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -59.13 -35.62 73.79 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.429 0.456 . . . . 64.33 111.031 -174.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -82.22 -12.38 80.85 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.574 -0.822 . . . . 74.05 112.873 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -103.9 110.14 22.16 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.073 0.464 . . . . 75.11 110.323 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 15.3 tm-20 -59.08 -44.36 91.87 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.48 -0.782 . . . . 71.32 111.12 -175.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -69.37 -34.96 75.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.578 -0.283 . . . . 73.03 111.442 -175.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.19 -34.71 66.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.88 0.372 . . . . 70.23 110.603 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.53 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 67.7 m -63.35 -31.19 72.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 73.35 110.702 178.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.0 mmm-85 -57.67 -35.8 71.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.368 0.604 . . . . 74.23 110.823 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.8 mt -89.54 -50.14 6.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.498 -0.773 . . . . 64.2 112.401 -175.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.562 ' O ' HG13 ' A' ' 58' ' ' VAL . 20.0 m-85 -108.82 3.97 23.06 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.332 0.864 . . . . 73.3 113.332 -165.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' A' ' 51' ' ' THR . 10.4 t30 -43.2 -56.75 3.29 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.237 0.828 . . . . 71.32 113.237 -174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -98.18 1.46 47.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.002 0.371 . . . . 74.3 112.002 -173.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' O ' HG22 ' A' ' 60' ' ' VAL . 96.5 mtt180 -132.96 55.12 1.91 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.897 -0.779 . . . . 75.51 108.897 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.998 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -80.37 -135.07 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.422 0 CA-C-O 118.825 -0.607 . . . . 74.24 111.978 -172.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.785 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 39.5 Cg_exo -5.45 68.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.476 0 C-N-CA 122.73 2.287 . . . . 64.13 113.474 -139.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -91.09 127.21 43.64 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 CA-C-N 115.649 -0.705 . . . . 64.13 110.104 -171.143 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 10' ' ' LEU . 2.7 tm? -93.0 107.3 19.11 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.675 -0.693 . . . . 72.02 109.577 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.502 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 83.6 t80 -98.71 138.22 36.19 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.077 -0.965 . . . . 65.51 111.305 -173.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.01 112.08 21.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.854 -0.612 . . . . 73.41 110.561 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.574 ' CG2' HG23 ' A' ' 11' ' ' VAL . 38.4 t -73.64 155.0 6.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.076 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 86.2 m-20 79.02 -49.0 0.43 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.913 0.885 . . . . 65.24 111.718 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -87.88 -20.45 25.98 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.734 0.302 . . . . 64.14 110.778 -178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.502 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 m-20 63.02 82.18 0.19 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.857 -0.611 . . . . 72.13 112.305 175.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? -167.17 139.91 3.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.641 -0.709 . . . . 64.13 110.19 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -76.34 126.2 30.56 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.153 -0.684 . . . . 72.45 109.153 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.466 ' HB3' HG12 ' A' ' 79' ' ' VAL . 83.6 mt -94.76 -79.21 0.43 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.397 0.618 . . . . 74.21 110.644 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' ' HB ' ' A' ' 79' ' ' VAL . 67.3 m -107.78 177.28 4.87 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.358 -0.837 . . . . 71.52 110.281 -175.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.521 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 6.6 p80 -131.78 -170.84 2.47 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 109.298 -0.63 . . . . 74.0 109.298 178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.462 ' HD2' ' HD2' ' A' ' 74' ' ' PHE . 34.4 p90 -44.54 132.65 6.12 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 123.737 0.648 . . . . 74.33 110.204 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.462 ' HD2' ' HD2' ' A' ' 73' ' ' TYR . 93.1 m-85 70.78 103.35 0.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 O-C-N 124.026 0.829 . . . . 72.24 109.673 -171.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.5 tp -53.77 121.71 8.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.157 -0.929 . . . . 63.32 111.789 -171.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.414 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 16.4 m-20 -76.83 -22.78 53.09 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.993 -0.549 . . . . 72.3 110.264 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 71.27 -60.4 0.52 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.929 0.892 . . . . 73.52 112.923 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -57.33 -43.77 83.67 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.893 0.378 . . . . 63.31 111.427 -176.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.484 ' HB ' ' SG ' ' A' ' 71' ' ' CYS . 83.5 t -66.61 -42.1 89.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.922 -0.581 . . . . 74.32 111.852 -175.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -71.69 -36.25 58.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 C-N-CA 120.085 -0.646 . . . . 64.23 110.244 177.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -58.9 -36.07 85.91 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.469 -0.872 . . . . 43.42 111.39 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.64 -30.81 71.57 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.529 0.332 . . . . 50.14 111.265 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -88.08 -36.38 16.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.954 0.407 . . . . 74.23 111.306 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.732 HD23 HD11 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -81.52 14.31 2.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.259 -0.428 . . . . 72.13 111.914 -175.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 1.001 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 30.7 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 116.132 -0.485 . . . . 73.14 109.801 174.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 109.978 -0.379 . . . . 72.33 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -156.19 95.81 1.64 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.475 0.655 . . . . 72.4 111.186 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -86.79 76.88 9.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.55 0.69 . . . . 62.24 109.318 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -85.84 98.05 10.54 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.399 -0.819 . . . . 71.51 110.593 -175.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -90.86 132.4 35.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.739 -0.664 . . . . 61.33 110.073 177.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -137.77 148.28 60.27 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.717 -0.674 . . . . 51.12 110.33 -177.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.84 -179.77 5.07 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.925 2.417 . . . . 72.11 111.722 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HB3' ' OH ' ' A' ' 83' ' ' TYR . 25.9 mmt180 -97.07 -42.64 7.78 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.089 -0.505 . . . . 74.12 110.18 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.627 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.2 tmtp? 72.03 113.66 0.06 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.011 -0.995 . . . . 70.14 110.873 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.48 HD11 HD11 ' A' ' 80' ' ' ILE . 44.7 mt -106.86 131.56 53.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.509 -0.769 . . . . 73.12 111.014 177.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.4 t -106.79 130.2 59.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 75.41 109.68 171.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 61' ' ' LEU . 46.5 t -108.46 108.13 24.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 116.006 -0.543 . . . . 74.2 109.816 177.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.921 ' HB2' HG23 ' A' ' 60' ' ' VAL . 79.2 m-85 -76.22 118.25 18.75 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.965 -0.754 . . . . 72.41 108.965 175.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.87 -161.98 8.98 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.519 -0.848 . . . . 71.4 112.18 -176.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -162.65 -176.52 5.04 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.455 -0.572 . . . . 72.14 109.455 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.25 108.89 2.45 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.541 -0.3 . . . . 42.01 110.535 179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 122.38 -144.93 16.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 121.087 -0.578 . . . . 73.22 112.067 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.8 m 70.69 95.76 0.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.056 0.542 . . . . 63.21 111.883 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.78 -39.59 81.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.633 -0.712 . . . . 72.31 109.897 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.545 HD23 ' OE2' ' A' ' 23' ' ' GLU . 64.6 mt -62.97 -30.94 71.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 73.31 111.794 -179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 45.7 t -58.89 -44.28 91.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.927 0.394 . . . . 62.2 110.561 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -61.71 -43.01 99.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 60.05 110.279 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.545 ' OE2' HD23 ' A' ' 20' ' ' LEU . 39.0 mt-10 -66.0 -39.37 90.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.502 -0.772 . . . . 75.21 110.836 -178.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.422 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 11.6 mtt -61.25 -50.46 72.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 51.24 111.119 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 71.2 mt -57.21 -46.56 84.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.374 -0.376 . . . . 64.32 111.19 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.69 -32.58 73.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.914 0.388 . . . . 70.15 111.158 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.4 m -72.66 -45.52 58.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.765 -0.652 . . . . 54.44 110.875 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 24' ' ' MET . 96.9 mt -66.39 -32.37 73.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.927 -0.579 . . . . 64.13 111.233 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -56.73 -42.55 79.45 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.959 0.409 . . . . 70.53 110.91 176.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 61.4 t -67.14 -40.63 85.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.901 -0.591 . . . . 62.55 110.998 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.1 mt -70.06 -33.47 71.97 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.013 -0.275 . . . . 74.51 111.479 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.58 HE22 ' HB2' ' A' ' 39' ' ' LEU . 37.6 mt-30 -58.75 -21.15 54.73 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.853 0.359 . . . . 75.44 111.327 177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.5 mtmt -77.98 -15.48 58.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.423 . . . . 70.54 111.653 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.1 -43.91 4.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.542 0.687 . . . . 73.44 109.445 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.548 ' HB3' HD12 ' A' ' 84' ' ' LEU . 47.3 m -138.51 109.14 6.59 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.234 -0.894 . . . . 71.43 109.928 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.7 t-105 -73.0 126.08 29.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.089 0.471 . . . . 74.33 110.963 -177.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.627 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 4.7 p90 -136.04 18.75 3.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.022 -0.535 . . . . 72.53 111.368 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 59.92 175.3 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.532 0.682 . . . . 54.02 111.302 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.58 ' HB2' HE22 ' A' ' 32' ' ' GLN . 6.5 tp -151.26 109.79 3.8 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.009 -0.541 . . . . 74.12 110.606 173.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -121.22 117.79 27.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.014 -0.539 . . . . 54.24 109.868 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.55 115.26 48.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 109.764 -0.458 . . . . 75.45 109.764 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.2 mt -114.59 122.27 68.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.244 -0.435 . . . . 72.22 111.071 -174.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -68.46 111.36 4.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.794 -0.639 . . . . 70.44 111.275 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 18.4 pt -81.0 -21.62 11.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.865 -0.421 . . . . 73.15 109.865 176.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -63.63 -18.95 64.47 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.901 -0.59 . . . . 74.34 111.476 -177.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -99.87 9.14 59.94 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.691 -0.766 . . . . 52.42 112.253 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -133.09 113.11 12.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.743 0.306 . . . . 50.35 110.395 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 52' ' ' ARG . 11.0 mm-40 -58.4 -42.6 87.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.248 -0.433 . . . . 62.32 111.248 -178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -60.5 -41.5 94.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.888 0.375 . . . . 74.31 110.678 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.502 HD23 HD12 ' A' ' 53' ' ' LEU . 77.1 mt -77.23 -32.09 55.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 64.34 111.019 -178.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.554 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 72.5 m -67.86 -25.63 65.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.316 0.579 . . . . 74.33 110.362 176.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 53.1 mmt-85 -78.44 -35.12 47.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.064 -0.516 . . . . 55.13 110.143 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.502 HD12 HD23 ' A' ' 50' ' ' LEU . 81.8 mt -70.76 -55.4 8.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 70.41 111.132 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -108.42 -67.68 0.96 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.006 -0.543 . . . . 70.32 112.065 -170.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 51' ' ' THR . 42.3 t-20 50.86 -87.38 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.984 0.803 . . . . 71.15 111.977 -170.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -89.38 21.86 3.16 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.398 0.618 . . . . 71.33 110.662 -177.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -130.55 59.73 1.65 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.345 -0.843 . . . . 63.34 108.839 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.762 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -92.0 -127.1 0.0 OUTLIER Pre-proline 0 N--CA 1.431 -1.388 0 CA-C-O 117.823 -1.084 . . . . 74.33 109.735 -178.578 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.762 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 80.4 Cg_exo -12.96 71.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.51 0 C-N-CA 122.504 2.136 . . . . 73.42 114.069 -143.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.921 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -102.11 118.97 49.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.323 -0.853 . . . . 73.15 111.456 -170.326 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 12' ' ' VAL . 50.8 mt -83.05 103.24 12.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.066 -0.515 . . . . 72.02 110.501 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -91.52 119.39 31.42 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.371 -0.831 . . . . 62.23 109.709 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.03 103.68 5.31 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.506 -0.77 . . . . 30.12 110.523 179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.521 HG21 ' HD2' ' A' ' 9' ' ' LYS . 61.0 t -74.61 150.12 7.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 108.977 -0.749 . . . . 71.04 108.977 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.0 t30 67.04 21.94 10.09 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.839 0.828 . . . . 45.04 109.696 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.473 ' HG3' ' HE1' ' A' ' 83' ' ' TYR . 1.0 OUTLIER -152.56 -44.41 0.1 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.31 -0.859 . . . . 75.11 109.091 -178.587 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.7 t70 70.89 81.41 0.16 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.944 -1.025 . . . . 71.13 111.355 176.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -176.34 164.25 2.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.472 -0.786 . . . . 73.33 109.82 175.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -91.66 129.82 37.57 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.315 -0.402 . . . . 73.01 109.98 172.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.0 mt -84.29 -49.58 8.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.168 -0.678 . . . . 74.34 109.168 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 14.5 t -170.99 167.91 7.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.395 -0.965 . . . . 61.51 108.395 177.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 1.7 p-80 -143.96 147.2 33.6 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.152 -0.219 . . . . 65.32 111.204 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 71.0 m-85 74.97 -44.95 0.56 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 124.174 0.921 . . . . 74.23 111.967 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -125.21 163.74 21.81 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.339 -0.615 . . . . 71.23 109.339 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.7 tp -113.64 101.2 9.1 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.368 -0.378 . . . . 70.21 111.566 -168.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -80.98 93.01 6.27 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.738 -0.467 . . . . 64.54 109.738 172.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.506 ' HA ' HG22 ' A' ' 80' ' ' ILE . 14.1 m -56.25 -34.42 66.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.84 -0.618 . . . . 75.33 110.574 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -58.82 -40.59 84.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.545 -0.752 . . . . 73.41 111.134 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 91.2 t -76.8 -49.26 24.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.131 -0.486 . . . . 73.41 111.716 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.506 HG22 ' HA ' ' A' ' 77' ' ' SER . 7.2 tp -63.36 -35.24 71.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 120.737 -0.385 . . . . 65.43 110.694 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.25 -36.19 91.4 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.89 -0.671 . . . . 60.45 111.708 177.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.16 75.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.936 0.398 . . . . 64.11 110.751 177.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.473 ' HE1' ' HG3' ' A' ' 66' ' ' GLU . 40.3 t80 -87.18 -50.09 6.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.837 -0.619 . . . . 65.12 111.839 -178.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.548 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -63.58 -45.56 89.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.289 -0.414 . . . . 61.3 111.503 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 C--N 1.32 -0.715 0 CA-C-N 116.325 -0.398 . . . . 74.51 110.762 -177.371 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 120.934 0.397 . . . . 74.21 110.789 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -148.29 105.13 3.59 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.341 -0.615 . . . . 60.32 109.341 172.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -80.38 -31.01 37.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.154 -0.475 . . . . 75.05 110.079 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 55.51 85.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.054 -0.976 . . . . 71.41 111.472 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.8 m -102.28 94.53 3.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.187 0.994 . . . . 71.51 110.952 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 44.3 mt-10 -130.76 123.09 19.92 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-N 114.564 -1.198 . . . . 73.33 109.477 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 88.3 Cg_endo -89.37 -170.75 0.47 Allowed 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.285 2.657 . . . . 54.42 112.889 -172.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 22.7 mmt180 -103.99 164.87 11.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.634 -0.712 . . . . 62.25 109.576 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.617 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 2.1 tmtp? -141.23 129.52 22.32 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.7 -0.481 . . . . 72.44 109.7 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 ' CD1' ' A' ' 80' ' ' ILE . 57.9 mt -113.84 139.85 48.82 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.079 -0.51 . . . . 63.23 111.598 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.547 HG23 ' CG2' ' A' ' 64' ' ' VAL . 53.3 t -112.26 129.57 67.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.63 -0.714 . . . . 73.22 109.336 170.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.614 HG22 HD23 ' A' ' 61' ' ' LEU . 39.2 t -99.11 114.25 36.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.752 -0.462 . . . . 52.31 109.752 174.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -89.62 126.01 35.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.928 -0.578 . . . . 52.23 110.464 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -159.05 -163.34 12.93 Favored Glycine 0 N--CA 1.443 -0.862 0 C-N-CA 120.737 -0.744 . . . . 63.44 111.714 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.527 ' HD2' ' OD1' ' A' ' 45' ' ' ASP . 1.2 ptm180 -149.34 160.54 43.33 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.195 -0.298 . . . . 75.34 110.195 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -62.45 110.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 73.43 111.237 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 132.4 -19.6 4.53 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.531 -0.842 . . . . 51.21 112.463 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 71.7 m -74.39 85.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.894 0.378 . . . . 73.53 110.539 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 44.0 m80 -70.86 -30.82 67.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 73.2 110.354 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.59 HD12 ' HB2' ' A' ' 73' ' ' TYR . 2.3 tm? -60.31 -32.12 70.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.775 -0.648 . . . . 72.51 109.779 176.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.754 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 53.9 t -67.76 -38.7 83.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.826 -0.625 . . . . 63.14 110.265 176.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' HD12 ' A' ' 25' ' ' ILE . 50.6 mt-10 -68.0 -32.59 73.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.639 -0.71 . . . . 64.42 110.51 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 18.2 mm-40 -62.89 -39.33 94.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.933 -0.576 . . . . 73.43 110.079 174.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 73' ' ' TYR . 78.6 mtp -69.33 -27.29 65.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.562 -0.744 . . . . 72.11 110.936 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 22' ' ' GLU . 74.0 mt -57.01 -43.41 80.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.462 -0.335 . . . . 72.34 110.17 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.75 -42.46 97.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 72.23 110.665 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.9 m -60.18 -47.98 83.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.73 -0.668 . . . . 54.41 110.668 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 88.5 mt -62.37 -43.13 99.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.795 -0.639 . . . . 73.43 111.009 -179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HD2' ' OE1' ' A' ' 32' ' ' GLN . 14.8 mmm180 -55.48 -43.48 75.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 72.22 111.575 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 90.0 t -65.46 -40.96 89.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.495 -0.321 . . . . 74.54 110.685 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.434 ' HA ' HD23 ' A' ' 31' ' ' LEU . 2.2 mt -66.76 -35.14 79.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.637 -0.256 . . . . 71.11 111.014 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.679 HE22 ' HB2' ' A' ' 39' ' ' LEU . 98.9 mt-30 -60.58 -21.38 62.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 63.01 111.503 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -78.05 -13.43 59.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.3 110.799 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -42.23 5.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.96 -0.563 . . . . 70.32 109.985 175.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 31.8 m -141.02 121.03 13.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.448 -0.796 . . . . 64.51 109.869 -178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -85.45 125.15 32.79 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.057 0.456 . . . . 74.12 111.199 -175.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.516 ' HB3' HD11 ' A' ' 84' ' ' LEU . 10.5 p90 -133.46 17.07 4.01 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.723 -0.671 . . . . 74.33 111.291 178.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.9 mt-10 58.67 -178.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.418 0.627 . . . . 74.12 111.313 -176.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.679 ' HB2' HE22 ' A' ' 32' ' ' GLN . 4.8 tp -151.25 109.93 3.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.033 -0.531 . . . . 64.15 110.456 173.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.617 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 3.2 tp10 -108.76 143.82 37.39 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.512 -0.551 . . . . 62.11 109.512 178.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.89 108.07 17.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.587 -0.523 . . . . 65.15 109.587 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.496 HD12 HG11 ' A' ' 11' ' ' VAL . 59.5 mt -118.78 118.45 57.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.082 0.468 . . . . 74.44 111.079 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -78.07 115.74 18.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.735 -0.666 . . . . 73.12 109.818 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.588 HG22 ' HB3' ' A' ' 50' ' ' LEU . 26.7 pt -71.74 -34.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.111 -0.495 . . . . 71.12 111.458 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -64.88 98.1 0.26 Allowed 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.37 0.605 . . . . 65.42 110.768 178.062 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 146.72 -37.79 1.17 Allowed Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.053 -1.219 . . . . 74.01 110.053 -176.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 50' ' ' LEU . 45.6 t-20 -97.65 109.02 21.86 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.527 -0.916 . . . . 74.41 108.527 173.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -50.62 -34.96 28.17 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 123.878 0.736 . . . . 74.24 111.383 -176.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.71 -49.97 19.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.396 -0.366 . . . . 64.44 110.756 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.588 ' HB3' HG22 ' A' ' 44' ' ' ILE . 32.9 mt -66.42 -34.45 77.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.795 -0.184 . . . . 74.43 111.36 -178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 31.1 m -57.78 -56.41 22.27 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.892 -0.323 . . . . 61.23 110.163 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' A' ' 52' ' ' ARG . 35.0 mmt180 -63.78 -31.55 72.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.594 0.235 . . . . 73.52 111.54 -178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.0 mt -69.89 -47.15 63.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.4 0.518 . . . . 74.34 112.4 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.494 ' HB2' HG21 ' A' ' 44' ' ' ILE . 96.9 m-85 -117.4 -9.56 10.87 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.33 1.233 . . . . 73.55 114.33 -167.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -76.84 82.97 3.42 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 119.078 0.854 . . . . 74.32 109.658 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.56 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 16.2 t70 -154.34 -59.42 0.12 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.633 -1.167 . . . . 74.51 109.075 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.56 ' HG3' ' O ' ' A' ' 56' ' ' ASP . 46.7 mtm180 -157.91 90.33 1.06 Allowed 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.28 -1.748 . . . . 72.4 106.28 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.487 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.12 -107.06 0.0 OUTLIER Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 113.473 0.916 . . . . 71.54 113.473 -161.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.754 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 96.4 Cg_exo -9.62 72.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.695 0 C-N-CA 122.709 2.272 . . . . 75.33 113.873 -140.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER -98.28 135.23 33.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.322 -0.854 . . . . 52.2 110.968 -168.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.614 HD23 HG22 ' A' ' 12' ' ' VAL . 34.9 mt -93.52 107.83 19.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.127 0.489 . . . . 64.41 110.796 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -92.45 123.6 35.87 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.636 -0.711 . . . . 73.23 110.519 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.8 107.14 7.78 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.803 -0.635 . . . . 74.44 109.553 176.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.547 ' CG2' HG23 ' A' ' 11' ' ' VAL . 92.3 t -69.78 -31.33 48.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.924 0.392 . . . . 65.32 111.661 -174.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.401 ' HB2' HH11 ' A' ' 8' ' ' ARG . 12.1 m120 -81.85 -44.73 16.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.139 0.495 . . . . 75.44 110.67 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.715 ' HB2' ' HE1' ' A' ' 83' ' ' TYR . 3.5 tp10 -85.55 -20.94 28.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.766 -0.652 . . . . 73.11 111.138 -174.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 62.23 74.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.664 -0.698 . . . . 75.23 110.56 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.43 ' HE3' ' CG ' ' A' ' 66' ' ' GLU . 19.6 ptpt -172.55 158.08 4.09 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.656 -0.702 . . . . 74.42 110.061 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -84.4 118.79 24.47 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.0 -0.371 . . . . 71.14 110.0 173.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 82.8 mt -88.01 -68.53 0.75 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.602 0.715 . . . . 65.51 110.788 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.566 ' HB2' HD12 ' A' ' 61' ' ' LEU . 85.6 m -119.21 170.74 8.82 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.697 -1.138 . . . . 64.13 110.41 -173.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -132.65 -172.23 2.86 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.704 -0.68 . . . . 74.01 109.645 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.688 ' HA ' ' SD ' ' A' ' 24' ' ' MET . 21.6 p90 -52.45 138.31 27.7 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.71 -0.478 . . . . 73.35 109.71 175.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 82.4 m-85 70.67 98.59 0.06 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.957 0.786 . . . . 75.23 108.978 -167.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 tp -52.39 119.93 4.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.684 -1.144 . . . . 61.42 112.454 -170.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.525 ' HB2' ' SG ' ' A' ' 71' ' ' CYS . 4.7 m-20 -66.21 -31.46 72.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.919 -0.582 . . . . 74.34 109.712 177.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.2 m 72.91 -54.63 0.69 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.118 -0.946 . . . . 73.4 112.834 172.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -74.63 -48.75 24.58 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.524 0.202 . . . . 72.44 111.504 -175.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 15.4 t -56.32 -49.35 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 112.412 0.523 . . . . 65.2 112.412 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.68 HD11 HD23 ' A' ' 84' ' ' LEU . 5.7 tp -64.6 -30.93 51.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 C-N-CA 120.302 -0.559 . . . . 72.34 110.507 177.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.82 -37.04 93.66 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.83 -0.7 . . . . 73.55 112.021 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.33 -30.68 70.57 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.39 0.614 . . . . 33.44 111.019 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.715 ' HE1' ' HB2' ' A' ' 66' ' ' GLU . 81.3 t80 -84.35 -36.18 22.69 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 61.31 110.798 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.68 HD23 HD11 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -87.84 13.54 10.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.807 -0.633 . . . . 74.5 111.759 -176.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.443 -0.344 . . . . 74.12 110.129 175.861 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.4 mtm . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 109.695 -0.483 . . . . 75.1 109.695 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -85.31 103.29 14.1 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.835 0.35 . . . . 70.15 110.585 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -113.33 -52.03 2.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.26 -0.427 . . . . 72.34 110.808 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -113.24 145.19 41.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.031 0.443 . . . . 73.14 110.896 -177.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.8 m -111.15 -172.49 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.639 -0.709 . . . . 74.51 111.243 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -87.44 159.22 50.59 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.948 -0.569 . . . . 72.33 110.535 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -80.96 166.54 18.87 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.467 2.112 . . . . 74.55 112.544 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 3.8 mpt_? -95.22 171.68 8.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.968 -0.56 . . . . 72.02 109.882 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 45.8 mtpt -126.56 146.99 49.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.834 0.35 . . . . 65.54 110.829 175.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.501 HD11 HD11 ' A' ' 80' ' ' ILE . 84.1 mt -120.42 128.24 53.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.814 -0.63 . . . . 75.22 110.1 174.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.534 HG22 ' HB3' ' A' ' 40' ' ' GLU . 55.4 t -108.5 127.41 64.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.896 -0.593 . . . . 55.12 110.305 177.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.689 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -98.94 108.2 21.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.772 -0.649 . . . . 74.43 109.276 174.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 1.018 ' HB2' HG23 ' A' ' 60' ' ' VAL . 19.0 m-85 -77.93 107.76 10.69 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.576 -0.45 . . . . 54.51 109.886 176.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -130.72 -145.51 5.71 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.946 -0.861 . . . . 32.42 110.946 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' HD11 ' A' ' 44' ' ' ILE . 6.7 ptm180 -174.78 110.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.878 0.339 . . . . 75.41 111.241 177.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 65.06 -87.66 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 115.663 -0.699 . . . . 75.32 111.727 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -147.46 134.52 5.21 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 121.03 -0.605 . . . . 74.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.574 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 44.1 t -153.29 141.29 20.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.918 -0.401 . . . . 74.43 109.918 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -60.22 -34.64 73.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 72.04 110.922 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.569 ' HG ' ' HD1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -73.72 -32.95 64.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.022 -0.535 . . . . 71.11 111.243 -177.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.574 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 70.7 m -64.28 -42.19 96.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.472 -0.331 . . . . 70.1 110.455 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -54.4 -38.25 65.98 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.222 0.534 . . . . 71.14 110.437 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -74.75 -48.38 25.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.665 -0.698 . . . . 71.23 111.345 -176.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 87.3 mtp -67.13 -42.95 83.57 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.112 -0.235 . . . . 73.01 111.282 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.52 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 71.8 mt -58.74 -48.28 86.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.401 0.143 . . . . 64.13 110.926 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.07 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.952 0.406 . . . . 63.22 110.892 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 m -62.91 -43.89 97.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.795 -0.639 . . . . 64.53 111.074 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.498 ' O ' ' HG3' ' A' ' 32' ' ' GLN . 92.9 mt -69.03 -35.25 76.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.31 -0.404 . . . . 64.12 111.373 -178.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm180 -57.77 -40.95 80.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.858 0.361 . . . . 62.0 110.864 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.46 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 78.5 t -67.31 -40.12 84.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.026 -0.534 . . . . 62.41 110.867 179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.1 mt -67.33 -32.06 72.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.69 -0.232 . . . . 72.42 111.23 179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 95.3 mt-30 -57.65 -23.01 48.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 72.33 111.339 178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.7 mtmt -76.58 -19.18 58.14 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.143 -0.481 . . . . 71.31 111.177 -177.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -105.46 -40.25 5.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.124 0.488 . . . . 70.45 110.545 176.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.575 ' HB3' HD12 ' A' ' 84' ' ' LEU . 19.6 m -140.92 120.38 13.16 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.915 -0.584 . . . . 61.31 109.756 -178.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.7 t-105 -83.81 123.98 30.46 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.116 0.484 . . . . 71.14 111.159 -176.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.557 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 5.6 p90 -134.88 19.07 3.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.487 -0.779 . . . . 73.23 110.519 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 18.7 mm-40 59.01 -178.23 0.08 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.923 -0.58 . . . . 75.12 110.302 -176.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.483 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.6 tp -151.95 108.71 3.49 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.619 -0.512 . . . . 71.43 109.619 170.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.534 ' HB3' HG22 ' A' ' 11' ' ' VAL . 19.4 tt0 -120.28 117.9 29.03 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.569 -0.741 . . . . 71.15 109.473 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.8 t -104.06 108.6 25.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.89 -0.595 . . . . 73.54 109.534 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 70.3 mt -110.12 118.01 56.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.92 -0.582 . . . . 60.15 110.001 -177.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 87.4 m-20 -70.19 138.08 51.48 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.953 -0.567 . . . . 70.13 110.51 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.8 pt -65.89 -25.74 36.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.524 -0.917 . . . . 63.15 108.524 169.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 43' ' ' ASN . 10.6 t70 -57.11 112.01 1.23 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.589 -1.187 . . . . 63.01 109.548 170.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 120.42 -25.91 7.17 Favored Glycine 0 N--CA 1.449 -0.478 0 N-CA-C 111.049 -0.82 . . . . 62.02 111.049 -174.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.411 HD22 HD12 ' A' ' 50' ' ' LEU . 92.0 m-20 -118.57 106.86 13.07 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.595 -0.52 . . . . 71.21 109.595 175.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.48 -33.79 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.216 -0.447 . . . . 74.32 111.176 -175.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -69.17 -35.57 76.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.453 -0.339 . . . . 74.24 110.516 -176.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.497 ' HB3' HG22 ' A' ' 44' ' ' ILE . 71.5 mt -73.36 -44.28 59.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 71.04 110.887 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.573 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 38.4 m -65.97 -25.24 67.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.037 0.446 . . . . 63.42 110.921 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -38.54 89.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.321 0.581 . . . . 61.12 110.099 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 75.8 mt -90.43 -52.89 4.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.383 -0.826 . . . . 73.1 111.463 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 57' ' ' ARG . 18.9 m-85 -102.74 21.0 16.23 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.758 0.651 . . . . 64.34 112.758 -167.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.573 ' HB2' ' O ' ' A' ' 51' ' ' THR . 9.9 t30 -50.81 -44.24 59.03 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.774 0.321 . . . . 75.21 111.191 176.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -124.27 24.96 7.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.218 1.009 . . . . 71.31 109.271 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.697 ' HB2' ' HA ' ' A' ' 54' ' ' TYR . 5.0 mmp_? -136.32 36.97 2.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.419 -0.956 . . . . 72.33 108.419 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.6 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -83.16 -108.09 0.0 OUTLIER Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.37 -0.824 . . . . 50.13 110.56 -173.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.6 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 31.0 Cg_exo -15.01 68.01 0.0 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.481 0 C-N-CA 122.622 2.214 . . . . 74.54 114.124 -144.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 1.018 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -98.99 115.78 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 114.933 -1.03 . . . . 44.43 110.497 -172.323 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.689 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -86.64 105.13 16.68 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.584 -0.734 . . . . 72.23 109.528 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -92.28 129.46 38.22 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.959 -1.019 . . . . 75.35 110.58 -176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -84.79 105.74 15.8 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.521 -0.763 . . . . 73.13 110.683 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.467 HG21 HG23 ' A' ' 11' ' ' VAL . 24.9 t -79.35 84.09 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 65.14 110.586 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.41 ' HB2' ' OH ' ' A' ' 83' ' ' TYR . 0.0 OUTLIER 176.23 -54.46 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.992 -1.004 . . . . 45.43 109.248 178.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -98.0 -12.82 21.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.067 -0.969 . . . . 72.13 111.007 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 61.8 78.1 0.3 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.89 -0.595 . . . . 70.25 109.799 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.58 163.92 6.72 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.515 -0.766 . . . . 64.24 110.213 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -84.58 142.95 29.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.341 174.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.6 mt -99.88 -32.71 10.86 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.506 -0.553 . . . . 71.21 109.506 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.8 t -173.7 151.74 1.92 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.176 -0.92 . . . . 72.32 109.244 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.66 ' HB3' HG12 ' A' ' 60' ' ' VAL . 2.6 p-80 -135.24 129.96 34.47 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.716 -0.476 . . . . 75.32 109.716 173.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.569 ' HD1' ' HG ' ' A' ' 20' ' ' LEU . 96.8 m-85 66.71 122.15 0.02 OUTLIER 'General case' 0 C--O 1.235 0.341 0 O-C-N 124.239 0.962 . . . . 75.25 110.728 -170.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.47 ' H ' ' CD1' ' A' ' 20' ' ' LEU . 84.5 m-85 65.67 -160.85 0.27 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.077 -1.419 . . . . 74.13 109.603 -176.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.5 tp -136.98 117.34 13.64 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 120.088 -0.645 . . . . 71.45 111.761 -172.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -86.86 87.65 7.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.135 -0.484 . . . . 65.11 109.741 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 m -59.33 -32.3 69.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.809 -0.632 . . . . 74.23 110.753 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -59.16 -43.39 92.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.837 -0.62 . . . . 72.43 111.169 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.4 t -75.33 -46.36 38.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 72.53 111.562 -176.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.847 HD11 HD23 ' A' ' 84' ' ' LEU . 7.9 tp -68.99 -30.91 48.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 C-N-CA 120.257 -0.577 . . . . 72.15 110.323 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.23 -29.52 75.51 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.561 -0.828 . . . . 63.33 111.524 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.98 -26.54 36.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.089 0.471 . . . . 73.41 110.508 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.41 ' OH ' ' HB2' ' A' ' 65' ' ' ASN . 63.9 t80 -87.46 -52.55 5.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.854 -0.612 . . . . 73.21 112.157 -177.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.847 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -66.14 -26.58 67.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.231 -0.44 . . . . 63.43 111.461 -170.169 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.322 -0.604 0 N-CA-C 110.188 -0.301 . . . . 75.32 110.188 177.04 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.53 -0.544 . . . . 75.21 109.53 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -125.37 101.36 6.92 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 110.159 -0.312 . . . . 71.32 110.159 176.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -88.36 102.31 14.73 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.138 0.494 . . . . 72.33 110.646 -178.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -84.57 100.82 11.66 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 75.41 110.555 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.0 m -129.83 140.77 48.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.847 -0.615 . . . . 73.31 109.699 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -140.56 143.34 32.27 Favored Pre-proline 0 C--N 1.316 -0.849 0 CA-C-N 116.012 -0.54 . . . . 75.41 109.682 -177.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -78.8 122.81 5.55 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.401 2.067 . . . . 74.32 111.569 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -110.35 105.08 13.96 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 71.15 110.318 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 1.9 tmtp? -71.47 146.33 48.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.063 -0.971 . . . . 74.04 110.247 -173.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.653 HD12 ' CD1' ' A' ' 37' ' ' PHE . 98.5 mt -124.48 136.85 54.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.073 0.464 . . . . 62.25 111.347 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.717 HG23 HG21 ' A' ' 64' ' ' VAL . 39.3 t -114.48 135.72 53.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.89 -0.595 . . . . 72.03 110.17 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.667 HG22 HD23 ' A' ' 61' ' ' LEU . 98.5 t -107.54 106.84 21.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.565 -0.531 . . . . 74.42 109.565 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.862 ' HB2' HG23 ' A' ' 60' ' ' VAL . 89.7 m-85 -76.99 122.98 25.67 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.764 -0.828 . . . . 74.22 108.764 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -157.51 -169.26 21.06 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 119.503 -1.332 . . . . 62.41 112.922 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.828 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.3 ptm180 -154.6 144.58 21.77 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.848 -0.797 . . . . 73.22 108.848 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -75.83 87.92 2.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.046 0.451 . . . . 75.33 110.037 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -176.08 32.1 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.551 -0.749 . . . . 51.12 111.511 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 6.8 p -170.58 138.99 1.53 Allowed 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.69 -0.485 . . . . 74.31 109.69 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -70.68 -29.89 66.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 54.55 112.127 -172.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.422 HD12 ' CD1' ' A' ' 73' ' ' TYR . 26.4 mt -55.78 -30.4 61.23 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.489 0.551 . . . . 72.12 112.489 -175.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.46 ' O ' HG13 ' A' ' 25' ' ' ILE . 76.1 m -54.5 -50.5 67.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.788 0.327 . . . . 63.21 110.863 178.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -64.75 -35.59 81.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.115 -0.493 . . . . 61.12 110.834 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -68.76 -44.1 74.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.669 -0.696 . . . . 71.53 111.309 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 58.6 mtp -65.65 -37.53 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.925 -0.31 . . . . 75.31 111.157 178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.0 mt -57.71 -52.38 58.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 110.143 -0.317 . . . . 63.11 110.143 176.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.44 89.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 60.13 110.879 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.8 m -59.15 -42.87 91.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.92 -0.582 . . . . 71.33 111.106 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.2 mt -68.45 -42.53 78.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 71.23 111.046 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.5 mtm180 -60.84 -26.44 67.35 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.97 0.359 . . . . 74.11 111.97 -175.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 92.2 t -67.79 -44.83 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.654 0.264 . . . . 75.52 110.602 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.87 -26.01 53.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.343 0.592 . . . . 74.13 109.82 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -60.98 -20.54 62.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.4 -0.818 . . . . 72.12 110.366 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -71.95 -16.83 62.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.828 -0.624 . . . . 75.04 111.514 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.35 -39.02 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.49 -0.323 . . . . 70.25 111.153 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.412 ' HB3' HD12 ' A' ' 84' ' ' LEU . 18.2 m -126.97 135.98 51.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.505 -0.316 . . . . 64.0 111.056 -174.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -84.13 110.93 18.88 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.224 -0.443 . . . . 72.34 110.478 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.896 ' HB3' HD11 ' A' ' 84' ' ' LEU . 32.4 p90 -132.57 6.18 4.06 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.93 -0.577 . . . . 72.04 110.744 176.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.582 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 3.8 mt-10 59.77 -177.88 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.675 . . . . 64.32 111.546 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -149.19 120.02 7.59 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.994 -0.548 . . . . 63.05 110.017 175.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.694 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 23.3 tt0 -131.29 118.03 19.78 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.822 -0.436 . . . . 62.42 109.822 177.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 58.8 t -103.9 114.24 42.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 109.543 -0.54 . . . . 63.23 109.543 178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 HG11 ' A' ' 11' ' ' VAL . 62.6 mt -112.62 116.89 53.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.256 0.55 . . . . 74.43 111.04 -176.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -71.75 107.45 4.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 62.5 110.582 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 29.7 pt -76.34 -10.73 13.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.286 0.565 . . . . 75.34 109.62 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -46.81 -39.2 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.421 -1.263 . . . . 74.24 112.651 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.5 20.99 48.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.526 -0.845 . . . . 75.25 112.9 -176.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.488 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 15.6 t-20 -137.26 110.36 7.77 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.882 0.341 . . . . 71.5 110.564 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -59.02 -33.78 71.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.334 -0.394 . . . . 63.35 111.807 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 66.2 m170 -66.21 -52.19 50.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 73.45 110.404 -178.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.35 -38.97 88.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.87 -0.604 . . . . 73.43 110.958 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.632 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 94.9 m -62.05 -40.97 97.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.872 0.367 . . . . 74.44 111.243 177.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 70.1 mtp85 -75.53 -31.98 60.3 Favored 'General case' 0 C--N 1.32 -0.705 0 O-C-N 122.077 -0.39 . . . . 63.13 110.576 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -64.12 -51.43 64.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.96 -0.564 . . . . 53.34 110.978 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -109.61 -72.25 0.73 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.067 -0.515 . . . . 72.02 111.596 -173.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.632 ' HB2' ' O ' ' A' ' 51' ' ' THR . 39.8 t-20 51.02 -81.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.691 0.797 . . . . 64.21 111.725 -169.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -91.23 8.6 35.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.686 0.755 . . . . 71.22 110.104 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.11 46.89 1.1 Allowed 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.203 -0.666 . . . . 72.41 109.203 169.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.828 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -81.86 -142.24 0.0 OUTLIER Pre-proline 0 N--CA 1.447 -0.6 0 CA-C-O 118.578 -0.725 . . . . 72.25 110.653 -178.781 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.815 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 82.7 Cg_exo -8.01 71.38 0.0 OUTLIER 'Trans proline' 0 N--CA 1.436 -1.885 0 C-N-CA 122.663 2.242 . . . . 51.52 113.885 -139.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.862 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -91.77 113.48 27.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 CA-C-N 115.453 -0.794 . . . . 53.35 110.136 -175.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.667 HD23 HG22 ' A' ' 12' ' ' VAL . 2.5 tm? -83.37 106.75 15.38 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.765 -0.652 . . . . 64.35 109.355 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -100.57 134.4 43.58 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.82 -1.082 . . . . 75.44 110.797 -175.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.57 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -84.91 106.19 16.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.841 -0.618 . . . . 75.41 110.943 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.717 HG21 HG23 ' A' ' 11' ' ' VAL . 49.1 t -86.31 91.93 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.937 0.399 . . . . 72.11 111.067 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 40.7 t-20 168.97 -57.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.666 -1.152 . . . . 42.13 108.21 176.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -91.21 -18.87 23.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.549 -0.75 . . . . 73.24 110.499 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.1 t70 68.05 87.02 0.13 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.689 -0.687 . . . . 71.24 110.002 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -167.37 165.53 14.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.312 -0.858 . . . . 75.1 109.467 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -108.99 137.8 46.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.892 -0.41 . . . . 74.03 109.892 -177.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.474 HD12 HD12 ' A' ' 61' ' ' LEU . 18.9 mt -96.79 -70.47 0.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.017 0.437 . . . . 74.0 110.869 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 21.4 p -143.91 160.63 40.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 51.44 110.189 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.54 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.8 p-80 -139.54 144.47 37.88 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.159 -0.216 . . . . 71.03 110.999 179.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 6.6 m-85 74.54 -43.79 0.54 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.831 0.852 . . . . 72.44 112.81 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -135.56 137.0 41.59 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.202 -0.666 . . . . 72.01 109.202 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 17.8 tp -89.71 110.71 21.58 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.049 0.452 . . . . 60.31 110.525 -176.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -64.97 -28.41 69.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.805 -0.634 . . . . 61.02 111.087 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 49.0 m 75.77 -40.99 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.804 -0.635 . . . . 72.31 112.143 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -76.6 -45.97 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.071 -0.393 . . . . 62.21 110.455 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.3 t -55.31 -49.83 69.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-N 116.171 -0.468 . . . . 72.24 111.68 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.525 HD11 HD11 ' A' ' 10' ' ' LEU . 7.2 tp -66.83 -34.75 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 64.32 110.397 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -70.24 -22.84 77.57 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.879 -0.677 . . . . 63.52 111.972 178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.16 -32.76 56.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.166 0.507 . . . . 72.22 110.173 176.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.441 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 85.2 t80 -87.09 -38.97 16.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.637 -0.71 . . . . 61.01 111.804 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.896 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -79.17 4.02 16.05 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.637 0.606 . . . . 74.41 112.637 -171.453 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.606 -0.516 . . . . 71.35 109.606 173.293 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.427 ' HB3' ' HB3' ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 108.81 -0.811 . . . . 71.01 108.81 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -53.58 -51.61 62.43 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.861 0.319 . . . . 64.12 111.861 -176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -122.07 70.12 0.96 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.396 0.617 . . . . 52.11 110.643 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 15.9 pt20 -90.79 160.57 15.7 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.74 -0.664 . . . . 73.3 109.588 176.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.465 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 31.8 m -121.52 155.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 72.13 112.497 -170.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 5' ' ' VAL . 1.2 mm-40 -145.83 160.4 43.96 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 114.673 -1.148 . . . . 70.21 108.609 177.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB3' ' HD1' ' A' ' 36' ' ' TRP . 87.3 Cg_endo -76.66 158.93 35.57 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.02 1.814 . . . . 64.11 111.827 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.696 ' NH2' ' O ' ' A' ' 85' ' ' SER . 44.9 mtt180 -81.21 -21.64 39.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.418 -0.356 . . . . 70.04 111.436 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.63 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 3.9 tmtp? 64.34 108.52 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.933 0.771 . . . . 62.43 112.828 170.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 80' ' ' ILE . 32.0 mt -105.43 133.01 50.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.618 -0.719 . . . . 52.21 110.811 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.6 t -109.85 131.69 60.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.687 -0.688 . . . . 64.52 109.84 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.52 HG22 ' CD2' ' A' ' 61' ' ' LEU . 62.3 t -99.31 109.39 24.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 N-CA-C 109.829 -0.434 . . . . 71.34 109.829 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.956 ' HB2' HG23 ' A' ' 60' ' ' VAL . 12.9 m-85 -84.33 120.33 26.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.138 -0.483 . . . . 71.52 110.124 176.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.485 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -138.87 170.5 23.99 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.157 -0.777 . . . . 63.02 111.157 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.413 ' HG2' HG21 ' A' ' 58' ' ' VAL . 12.2 ptm180 -135.72 123.66 22.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.12 0.46 . . . . 75.23 110.813 178.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 61.27 -81.53 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 O-C-N 124.262 0.976 . . . . 60.32 112.454 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -160.82 139.36 6.01 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.673 -0.775 . . . . 44.12 112.203 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 75.2 m -148.84 115.71 6.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.1 -0.333 . . . . 73.02 110.1 178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -56.48 -46.84 80.25 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.983 0.421 . . . . 63.11 111.098 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.568 HD11 ' H ' ' A' ' 74' ' ' PHE . 1.9 tm? -63.98 -32.15 73.59 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.767 -0.651 . . . . 63.12 110.707 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.581 ' HB2' ' HG3' ' A' ' 59' ' ' PRO . 42.1 t -67.33 -38.68 85.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.535 -0.302 . . . . 62.23 110.557 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.21 -39.92 73.24 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.493 0.663 . . . . 75.4 110.22 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -69.89 -34.18 73.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.085 -0.961 . . . . 54.22 110.843 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.494 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 73.3 mtp -68.0 -42.18 81.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 43.43 109.982 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 79.7 mt -55.83 -46.12 79.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.748 -0.66 . . . . 55.12 110.728 178.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.01 98.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.509 . . . . 73.34 110.91 177.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.1 m -60.52 -39.09 86.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.291 0.567 . . . . 73.51 110.717 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.537 HD11 HD21 ' A' ' 61' ' ' LEU . 84.3 mt -71.24 -33.8 70.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.999 -0.546 . . . . 63.3 111.684 -177.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.14 -40.73 96.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.362 . . . . 72.42 110.213 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 63.0 t -66.76 -43.65 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 64.22 110.858 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.457 ' HA ' HD23 ' A' ' 31' ' ' LEU . 7.0 mt -63.03 -33.66 75.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.69 -0.232 . . . . 70.33 111.27 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.828 HE22 ' HB2' ' A' ' 39' ' ' LEU . 47.5 mt-30 -58.94 -25.27 63.35 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.876 0.324 . . . . 63.23 111.876 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -75.37 -19.39 59.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.077 0.465 . . . . 74.54 110.734 -179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -101.33 -44.68 5.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 72.34 109.689 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' HD12 ' A' ' 84' ' ' LEU . 13.5 m -139.22 120.35 14.67 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 64.23 109.582 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.434 ' HD1' ' HB3' ' A' ' 7' ' ' PRO . 56.5 t-105 -83.61 124.01 30.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.391 0.615 . . . . 64.51 111.226 -174.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.53 ' CD1' HD12 ' A' ' 10' ' ' LEU . 4.4 p90 -135.45 13.95 3.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.864 -0.607 . . . . 75.41 111.369 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 17.0 mm-40 60.44 174.45 0.1 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.465 0.65 . . . . 72.21 111.584 -177.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.828 ' HB2' HE22 ' A' ' 32' ' ' GLN . 9.1 tp -151.32 112.76 4.38 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.133 -0.485 . . . . 61.22 110.726 173.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.63 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 28.1 tt0 -124.77 118.76 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -99.94 120.52 49.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.865 -0.421 . . . . 73.23 109.865 -177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.41 HD12 HG11 ' A' ' 11' ' ' VAL . 71.2 mt -125.82 121.13 59.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.941 0.401 . . . . 73.12 111.178 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 9.3 m120 -66.62 125.7 26.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.742 -0.663 . . . . 72.54 111.162 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.44 HG22 HD13 ' A' ' 50' ' ' LEU . 22.3 pt -88.12 -23.24 6.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.459 -0.337 . . . . 74.0 110.268 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -59.92 117.18 4.73 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.383 0.611 . . . . 64.43 110.429 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.24 -31.02 6.95 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.482 -0.781 . . . . 31.34 111.465 -175.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -92.79 113.34 25.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.233 -0.654 . . . . 73.02 109.233 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -38.13 89.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.696 -0.229 . . . . 64.1 111.553 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -60.6 -51.51 69.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.28 0.562 . . . . 74.04 110.4 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.44 HD13 HG22 ' A' ' 44' ' ' ILE . 92.6 mt -67.58 -37.56 82.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.668 -0.697 . . . . 63.44 111.253 -178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.676 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 63.8 m -66.57 -43.46 84.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.027 0.441 . . . . 75.54 110.842 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -67.28 -37.39 83.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.819 0.342 . . . . 75.4 110.293 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.2 -55.92 13.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.047 -0.524 . . . . 63.21 111.46 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -103.86 -66.07 0.97 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.394 -0.366 . . . . 71.5 111.529 -171.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.676 ' HB2' ' O ' ' A' ' 51' ' ' THR . 58.7 t30 51.92 -83.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 113.111 0.782 . . . . 72.44 113.111 -175.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -85.44 -16.41 39.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.983 -0.553 . . . . 72.0 111.676 -170.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.62 78.0 1.48 Allowed 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.347 -1.353 . . . . 64.35 107.347 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.55 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.28 -97.54 0.0 OUTLIER Pre-proline 0 N--CA 1.423 -1.794 0 CA-C-O 118.163 -0.922 . . . . 70.23 110.676 -175.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.581 ' HG3' ' HB2' ' A' ' 21' ' ' CYS . 85.3 Cg_exo -21.29 75.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.821 2.347 . . . . 75.25 114.154 -149.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.956 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -107.23 122.89 62.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.267 -0.879 . . . . 71.51 110.798 -170.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 28' ' ' LEU . 48.1 mt -85.01 109.56 18.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.084 0.469 . . . . 72.42 110.769 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 88.1 t80 -92.46 124.11 36.26 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.448 -0.796 . . . . 74.31 110.691 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.83 109.17 16.73 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.744 . . . . 70.15 109.719 175.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.614 HG21 ' HD2' ' A' ' 9' ' ' LYS . 57.8 t -73.21 -20.53 18.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.289 -0.414 . . . . 43.41 111.794 -173.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -72.49 -51.78 18.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.951 0.352 . . . . 64.42 111.951 -178.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -100.95 -5.19 26.27 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.823 0.344 . . . . 72.21 111.464 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 63.61 78.87 0.27 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.495 0.664 . . . . 65.25 111.344 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.465 ' NZ ' ' HB2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -176.98 177.53 1.27 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.111 -0.95 . . . . 73.12 108.82 175.175 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.52 156.38 17.32 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 120.905 0.383 . . . . 72.32 110.694 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.414 ' HB3' HG12 ' A' ' 79' ' ' VAL . 66.1 mt -111.1 -76.32 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.621 0.724 . . . . 74.04 110.403 177.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 41.5 t -115.7 142.92 46.1 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.574 -1.194 . . . . 64.34 109.737 -175.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 17.7 p-80 -133.13 130.05 38.72 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.302 -0.408 . . . . 73.44 110.481 177.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.404 ' CZ ' ' HD2' ' A' ' 59' ' ' PRO . 71.4 m-85 68.7 140.02 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.099 -0.955 . . . . 74.42 112.348 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.568 ' H ' HD11 ' A' ' 20' ' ' LEU . 98.8 m-85 58.1 -105.77 0.28 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.205 -1.361 . . . . 63.34 111.352 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 12.0 tp 172.36 107.46 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 123.764 0.665 . . . . 74.04 109.537 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -71.73 -25.68 62.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 74.3 109.966 176.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.0 m 69.08 -55.03 0.56 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.116 -0.947 . . . . 65.14 112.189 178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -59.12 -43.7 91.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.689 0.28 . . . . 71.11 111.733 -177.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 70' ' ' LEU . 84.1 t -64.12 -46.28 94.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.476 -0.329 . . . . 64.43 111.74 -177.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.533 ' CD1' HD11 ' A' ' 10' ' ' LEU . 6.0 tp -70.51 -33.86 55.2 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 C-N-CA 119.989 -0.685 . . . . 41.4 109.79 176.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.63 99.69 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.797 -0.716 . . . . 54.3 111.587 176.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.95 -32.02 71.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 63.25 110.907 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -83.93 -33.97 24.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.834 -0.621 . . . . 74.12 111.065 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.7 OUTLIER -92.04 13.56 18.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.096 -0.502 . . . . 70.01 111.926 -176.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.696 ' O ' ' NH2' ' A' ' 8' ' ' ARG . 67.7 m . . . . . 0 C--N 1.325 -0.467 0 N-CA-C 110.028 -0.36 . . . . 65.14 110.028 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.0 ttm . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 120.92 0.39 . . . . 73.14 110.82 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -64.87 151.67 44.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.273 -0.421 . . . . 72.33 111.136 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -119.1 142.36 47.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.838 -0.619 . . . . 65.41 109.404 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -154.67 163.93 39.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.416 -0.356 . . . . 71.22 110.667 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.1 m -119.93 -177.84 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 116.177 -0.465 . . . . 75.54 110.622 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.485 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 13.4 pt-20 -88.8 163.07 36.62 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.755 -0.657 . . . . 72.44 109.439 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.485 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 61.2 Cg_endo -70.44 162.92 40.67 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.118 1.879 . . . . 63.3 111.461 177.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -101.52 173.27 6.51 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.366 -0.379 . . . . 75.23 110.482 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.536 ' HG2' ' HB2' ' A' ' 38' ' ' GLU . 19.8 mtpt -135.05 126.6 28.78 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.975 -0.557 . . . . 74.41 109.946 174.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.405 HD11 HD11 ' A' ' 80' ' ' ILE . 37.0 mt -108.45 120.79 43.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.868 -0.605 . . . . 75.25 110.305 173.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 40' ' ' GLU . 79.6 t -102.11 126.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.726 -0.67 . . . . 73.43 109.573 176.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.558 HG22 HD23 ' A' ' 61' ' ' LEU . 59.2 t -96.55 105.98 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.034 0 N-CA-C 109.193 -0.669 . . . . 64.33 109.193 175.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.581 ' O ' HG23 ' A' ' 60' ' ' VAL . 35.6 m-85 -82.95 105.15 13.71 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.26 -0.644 . . . . 74.21 109.26 174.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.57 -168.15 12.65 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.568 -0.825 . . . . 60.33 111.488 -177.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.876 ' HG2' HG11 ' A' ' 58' ' ' VAL . 3.1 ptm180 -169.76 -159.03 0.2 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.882 -0.784 . . . . 74.42 108.882 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -50.98 109.04 0.28 Allowed 'General case' 0 C--N 1.318 -0.793 0 O-C-N 124.185 0.928 . . . . 73.21 109.271 171.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -155.31 -170.69 21.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.299 -0.953 . . . . 45.0 112.8 -176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.5 t -119.02 -155.09 0.59 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.562 0.22 . . . . 73.42 110.424 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.9 p-80 -52.92 -33.23 49.69 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.988 1.107 . . . . 71.54 113.988 -170.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 20' ' ' LEU . 16.8 mt -56.62 -34.75 67.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.602 0.637 . . . . 62.41 112.025 -176.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 37.0 t -63.62 -43.9 95.5 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.425 -178.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -85.24 -21.29 29.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.52 -0.309 . . . . 73.51 111.29 -177.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.7 mt-10 -66.19 -44.74 83.1 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.864 0.364 . . . . 72.14 110.121 175.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.555 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 91.9 mtp -62.77 -40.58 97.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.001 -0.545 . . . . 75.43 110.28 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.564 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.6 mt -58.35 -49.85 80.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 54.4 110.562 176.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.48 94.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.362 -0.381 . . . . 63.23 111.194 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -61.3 -43.38 98.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.032 -0.531 . . . . 73.52 110.579 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.624 ' HB3' ' HE1' ' A' ' 37' ' ' PHE . 83.1 mt -66.04 -30.8 71.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 75.01 111.2 -179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 14.3 mmm180 -63.16 -38.67 92.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.95 0.405 . . . . 72.44 110.411 177.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.9 t -73.4 -40.54 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 73.34 110.617 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 31' ' ' LEU . 6.8 mt -64.81 -31.79 73.18 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 74.1 111.142 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -58.23 -24.85 60.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.719 0.295 . . . . 52.32 111.701 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.7 mtmt -70.22 -28.97 65.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 74.54 110.537 178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -93.71 -44.8 7.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 70.51 110.462 178.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.4 m -143.17 117.86 9.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.673 -0.694 . . . . 71.04 110.142 -175.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.9 t-105 -78.13 128.92 34.53 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.11 0.481 . . . . 62.11 110.834 -178.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.624 ' HE1' ' HB3' ' A' ' 28' ' ' LEU . 2.6 p90 -141.72 20.18 2.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.597 -0.729 . . . . 70.21 110.82 177.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.536 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 63.5 mm-40 59.28 -178.2 0.09 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.147 0.499 . . . . 72.51 110.849 -179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.555 HD21 HG23 ' A' ' 25' ' ' ILE . 4.5 tp -151.6 109.9 3.76 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.686 -0.405 . . . . 71.24 110.718 172.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.515 ' HB3' HG22 ' A' ' 11' ' ' VAL . 24.1 tt0 -124.15 117.65 25.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.842 -0.617 . . . . 75.11 109.426 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 51.7 t -112.57 124.07 68.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.134 -0.484 . . . . 75.15 109.866 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.0 mt -128.9 117.75 45.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.419 -0.355 . . . . 71.53 111.176 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -67.69 114.47 6.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.998 -0.546 . . . . 51.33 111.047 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.6 pt -83.38 -8.85 11.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.452 -0.34 . . . . 65.03 110.62 177.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 15' ' ' ARG . 5.6 p-10 -74.97 -17.13 60.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.334 -0.394 . . . . 74.14 110.581 178.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.31 -8.58 59.87 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.942 -0.646 . . . . 53.54 111.954 177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -125.71 101.08 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.966 -0.383 . . . . 65.34 109.966 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 48' ' ' GLU . 1.6 mp0 -54.43 -33.87 60.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.898 -0.592 . . . . 64.13 112.017 -174.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -66.57 -37.53 85.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.832 0.349 . . . . 72.52 110.263 -177.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 53' ' ' LEU . 74.8 mt -74.9 -24.41 58.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.373 -0.376 . . . . 54.33 110.284 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 4.8 m -64.99 -33.68 76.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.407 0.622 . . . . 63.15 109.62 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 mmt85 -77.37 -32.51 55.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.864 -0.607 . . . . 72.51 110.207 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 50' ' ' LEU . 82.7 mt -79.15 -24.38 43.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.531 -0.759 . . . . 70.34 111.627 -178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -136.44 -75.51 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.645 0.239 . . . . 72.41 111.645 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.641 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.3 t30 46.33 -86.71 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.887 0.875 . . . . 73.52 112.882 -171.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -91.29 49.68 1.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.639 0.733 . . . . 73.25 110.29 -173.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.573 ' O ' HG22 ' A' ' 60' ' ' VAL . 5.7 ttm-85 -156.44 32.05 0.32 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.703 -1.221 . . . . 44.24 107.703 177.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.876 HG11 ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -73.78 -141.93 0.0 OUTLIER Pre-proline 0 N--CA 1.452 -0.33 0 N-CA-C 113.272 0.841 . . . . 43.35 113.272 -166.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.76 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 41.0 Cg_exo -2.53 73.3 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.657 0 C-N-CA 122.305 2.003 . . . . 72.14 112.956 -136.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -93.42 116.13 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 114.766 -1.107 . . . . 60.23 111.044 -169.213 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.558 HD23 HG22 ' A' ' 12' ' ' VAL . 32.9 mt -82.65 103.02 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.092 0.472 . . . . 72.54 110.35 173.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.503 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 82.1 t80 -95.19 126.05 40.25 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.171 -0.922 . . . . 70.01 110.013 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.98 108.26 15.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.146 -0.479 . . . . 45.15 110.739 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.451 ' CG2' HG23 ' A' ' 11' ' ' VAL . 51.0 t -77.93 147.19 7.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.11 -0.495 . . . . 63.01 109.731 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 67.45 26.35 8.32 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.076 -0.713 . . . . 74.14 109.076 -173.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.575 ' HG2' ' HE2' ' A' ' 68' ' ' LYS . 7.7 tp10 -149.27 -45.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.051 -0.977 . . . . 71.23 109.433 -176.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.503 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 1.5 t70 73.28 37.63 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.972 -1.013 . . . . 75.54 111.591 172.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HE2' ' HG2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -149.47 167.04 27.34 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.137 -0.483 . . . . 74.43 110.045 176.277 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -94.24 157.97 15.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.025 0.44 . . . . 64.14 111.633 -172.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.443 ' CD1' HD13 ' A' ' 80' ' ' ILE . 54.2 mt -112.7 -62.81 1.53 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 62.45 110.033 173.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.3 t -153.8 153.6 32.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 70.13 110.098 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.534 ' CD2' HG13 ' A' ' 60' ' ' VAL . 0.0 OUTLIER -128.43 149.35 50.6 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.962 -0.385 . . . . 74.42 109.962 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.411 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 68.0 m-85 74.85 -33.64 0.25 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.81 0.844 . . . . 71.1 113.037 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -141.48 -177.91 5.38 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.016 -0.735 . . . . 75.41 109.016 -174.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 tp -121.1 111.93 18.05 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 120.779 -0.368 . . . . 74.33 111.195 -174.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -90.69 98.3 11.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.185 -0.672 . . . . 64.41 109.185 175.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.0 m -61.55 -32.09 72.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.09 -0.505 . . . . 72.02 111.635 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.4 -48.33 67.68 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.86 0.362 . . . . 55.52 110.774 -176.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -66.86 -48.82 78.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.235 -0.439 . . . . 70.14 111.993 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.533 HD11 HD23 ' A' ' 84' ' ' LEU . 8.6 tp -69.69 -30.72 45.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.432 -0.507 . . . . 71.22 110.189 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.42 -30.48 77.69 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.805 -0.712 . . . . 70.11 111.61 174.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.7 -37.82 55.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.927 0.394 . . . . 74.32 110.697 176.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -78.69 -54.86 5.66 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.021 -0.536 . . . . 72.41 111.515 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.559 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.4 OUTLIER -76.3 -38.4 56.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.126 -0.488 . . . . 43.35 110.851 -175.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 115.557 -0.747 . . . . 72.3 111.243 -176.694 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ttt . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 120.418 0.152 . . . . 64.54 111.267 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -56.59 -51.81 67.22 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.797 0.332 . . . . 65.44 110.891 -177.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -110.68 99.57 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.223 -0.444 . . . . 64.25 110.764 -179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.81 84.18 6.39 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.019 -0.734 . . . . 73.33 109.019 176.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.6 m -85.2 132.79 30.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.568 -0.742 . . . . 53.13 111.264 -176.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.48 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 41.4 mt-10 -133.15 158.07 76.71 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.098 -0.956 . . . . 73.41 109.504 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.48 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 68.4 Cg_endo -68.79 132.12 24.2 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.52 2.147 . . . . 60.35 113.025 -172.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.976 ' NH1' ' O ' ' A' ' 85' ' ' SER . 8.7 ptp180 -88.31 130.34 35.15 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.589 -0.893 . . . . 75.23 108.589 174.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.62 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 84.5 tttt -96.09 155.98 16.53 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.134 0.42 . . . . 71.34 112.134 -166.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.614 HD11 HD11 ' A' ' 80' ' ' ILE . 89.7 mt -125.85 148.3 49.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.908 -0.587 . . . . 71.4 110.215 173.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.609 HG23 HG21 ' A' ' 64' ' ' VAL . 55.1 t -127.03 135.51 63.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 116.239 -0.437 . . . . 71.3 109.958 175.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.724 HG22 HD23 ' A' ' 61' ' ' LEU . 86.8 t -108.85 119.62 58.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.344 -0.389 . . . . 50.34 110.155 176.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -95.9 115.84 28.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.843 -0.429 . . . . 63.51 109.843 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -139.07 -170.48 11.86 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.379 -0.915 . . . . 65.02 112.104 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HB2' ' OD2' ' A' ' 45' ' ' ASP . 16.4 ptm180 -154.48 -177.35 6.41 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.827 -0.434 . . . . 74.12 109.827 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -78.32 155.6 30.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.146 -0.479 . . . . 72.52 110.825 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.33 31.87 45.03 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.937 -0.649 . . . . 52.03 112.138 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 78.1 m -143.09 94.08 2.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.803 0.335 . . . . 71.33 110.918 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -70.93 -28.75 64.73 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.24 0.543 . . . . 72.42 110.031 175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.46 -34.45 64.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.09 -0.959 . . . . 44.34 110.279 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 37.9 t -68.13 -37.19 80.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.037 -0.529 . . . . 52.32 110.197 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.407 ' HA ' HD12 ' A' ' 25' ' ' ILE . 40.6 mt-10 -68.92 -33.14 73.26 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.217 0.532 . . . . 73.43 110.094 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.08 -36.7 84.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.657 -0.701 . . . . 73.13 110.409 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 85.2 mtp -63.99 -43.97 94.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.026 -0.533 . . . . 43.43 109.928 174.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.0 mt -55.05 -49.57 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 CA-C-N 115.944 -0.571 . . . . 60.51 110.99 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.3 -40.15 93.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.933 0.397 . . . . 72.01 110.919 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -62.98 -41.36 99.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.798 -0.637 . . . . 64.14 110.688 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.549 HD23 HD13 ' A' ' 39' ' ' LEU . 8.3 mp -66.45 -33.25 75.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.774 -0.648 . . . . 62.14 111.396 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 8.9 mmm180 -62.36 -42.19 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.893 0.378 . . . . 71.41 110.372 179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.533 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 62.8 t -66.38 -44.37 90.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 64.22 110.71 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.41 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 11.8 mt -63.72 -33.61 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.53 -0.305 . . . . 73.45 111.505 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.628 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 31.3 mt-30 -58.4 -22.41 53.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.872 0.367 . . . . 72.25 111.898 178.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 49.6 mtmt -81.91 -11.45 58.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.165 0.507 . . . . 62.4 110.769 -178.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -110.56 -44.23 3.72 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.622 -0.717 . . . . 71.24 109.961 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.467 ' HB3' HD12 ' A' ' 84' ' ' LEU . 73.0 m -137.92 115.2 11.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.998 -1.001 . . . . 63.25 109.535 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -80.86 125.16 29.76 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.065 0.46 . . . . 71.02 110.806 -178.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.859 ' HB3' HD11 ' A' ' 84' ' ' LEU . 5.6 p90 -134.37 17.74 3.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.582 -0.736 . . . . 72.25 110.869 178.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.62 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 12.9 mm-40 59.98 -179.41 0.09 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.33 0.586 . . . . 75.52 110.304 -175.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.628 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 5.2 tp -152.54 112.55 4.0 Favored 'General case' 0 C--N 1.313 -1.018 0 C-N-CA 120.538 -0.465 . . . . 75.52 111.291 172.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.516 ' HB3' HG22 ' A' ' 11' ' ' VAL . 22.7 tt0 -120.01 117.8 28.98 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.412 -0.588 . . . . 72.34 109.412 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.5 t -105.61 108.23 24.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.945 -0.571 . . . . 75.31 109.694 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 50.4 mt -108.5 113.02 42.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.852 -0.613 . . . . 71.52 110.526 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.453 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.7 m120 -81.1 124.77 29.49 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.644 . . . . 65.44 110.17 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.675 HG22 ' HB3' ' A' ' 50' ' ' LEU . 43.0 pt -69.97 -30.12 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.334 -0.394 . . . . 74.33 110.106 177.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -63.7 94.29 0.09 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.208 0.527 . . . . 63.25 109.874 170.519 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.02 -27.94 2.27 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.55 -1.02 . . . . 70.21 110.55 -174.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -120.65 109.29 15.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.938 -0.393 . . . . 65.51 109.938 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -58.5 -42.75 88.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.048 -0.524 . . . . 75.35 110.712 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -58.48 -41.26 84.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.411 . . . . 74.1 111.25 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.675 ' HB3' HG22 ' A' ' 44' ' ' ILE . 80.9 mt -76.31 -30.33 57.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.585 -0.279 . . . . 63.41 110.901 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 63.4 m -61.96 -45.35 94.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.085 0.469 . . . . 74.2 110.081 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -63.99 -30.91 71.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.063 -0.517 . . . . 71.23 110.926 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 83.2 mt -86.07 -44.28 12.41 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 113.084 0.772 . . . . 75.11 113.084 -174.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.518 ' HB2' HG21 ' A' ' 44' ' ' ILE . 92.7 m-85 -117.03 -2.92 11.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.817 1.043 . . . . 73.53 113.817 -167.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -77.76 82.85 4.13 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 119.485 -0.886 . . . . 71.44 111.219 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.0 t70 171.63 -48.29 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 114.557 -1.201 . . . . 72.1 108.484 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 60' ' ' VAL . 18.0 ptt180 -109.1 54.11 0.67 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.419 -1.264 . . . . 71.13 109.613 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.811 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.78 -144.97 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 112.228 0.455 . . . . 50.44 112.228 -171.402 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.811 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 67.8 Cg_exo -4.89 77.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.642 0 C-N-CA 122.599 2.199 . . . . 64.45 113.72 -138.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -92.12 128.05 43.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.087 -0.96 . . . . 74.22 110.469 -171.641 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.724 HD23 HG22 ' A' ' 12' ' ' VAL . 2.1 tm? -102.03 108.11 19.44 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.381 -0.599 . . . . 75.21 109.381 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -99.86 141.91 32.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.347 -0.842 . . . . 73.52 111.258 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.598 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -92.38 111.5 23.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.892 -0.594 . . . . 73.22 111.0 -178.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.609 HG21 HG23 ' A' ' 11' ' ' VAL . 21.6 t -99.42 88.37 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.587 0.708 . . . . 44.32 110.819 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 175.29 -44.34 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.045 -1.835 . . . . 73.31 106.045 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 54.1 tt0 -125.53 104.83 8.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.71 -1.586 . . . . 60.2 107.474 163.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -52.12 90.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 124.264 0.977 . . . . 54.24 111.741 -175.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 66' ' ' GLU . 25.6 pttm -160.85 156.62 25.34 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.842 -1.072 . . . . 64.31 110.105 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -89.84 141.04 29.01 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.637 -0.505 . . . . 74.15 109.637 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 72.3 mt -94.21 -55.67 3.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.843 0.354 . . . . 72.45 110.166 177.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.2 t -158.63 175.13 14.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.03 -0.532 . . . . 52.1 109.852 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 7.7 p80 -144.2 136.77 26.84 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.802 -0.444 . . . . 52.02 109.802 177.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 96.0 m-85 73.99 139.56 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.518 1.136 . . . . 63.13 111.268 -174.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 61.15 -141.84 0.5 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.063 -0.971 . . . . 73.51 110.132 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 75' ' ' LEU . 14.0 tp -153.83 113.93 3.91 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.463 -0.495 . . . . 72.4 110.419 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.417 ' OD2' ' HB ' ' A' ' 79' ' ' VAL . 4.4 p-10 -58.66 -38.99 79.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.653 -0.703 . . . . 74.2 109.965 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.68 -49.8 0.7 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.364 -0.834 . . . . 65.33 112.004 176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -79.22 -40.06 31.65 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.618 0.229 . . . . 64.42 111.618 -176.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.417 ' HB ' ' OD2' ' A' ' 76' ' ' ASP . 54.1 t -69.53 -47.65 70.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.62 0.247 . . . . 74.25 110.535 -178.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.614 HD11 HD11 ' A' ' 10' ' ' LEU . 10.2 tp -65.57 -31.07 52.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 120.845 -0.342 . . . . 54.13 110.095 174.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.66 -29.14 74.48 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 120.768 -0.73 . . . . 64.33 111.61 176.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -80.73 -39.58 26.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.265 0.555 . . . . 72.34 110.278 176.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.598 ' CZ ' ' HB1' ' A' ' 63' ' ' ALA . 82.3 t80 -71.88 -32.07 67.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.576 -0.738 . . . . 75.42 111.493 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.859 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -92.22 8.12 39.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.118 -0.492 . . . . 71.53 111.323 -178.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.976 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 8.3 t . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.176 -0.675 . . . . 52.54 109.176 176.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.947 0.404 . . . . 61.24 110.284 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -167.64 157.91 10.76 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.333 -0.617 . . . . 73.24 109.333 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -103.01 144.35 31.39 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.219 -0.289 . . . . 75.12 110.219 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -106.88 174.85 5.71 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.524 -0.547 . . . . 71.5 109.524 176.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.2 m -77.22 178.4 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.777 0.799 . . . . 54.43 111.893 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.592 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.9 pt-20 -133.16 166.9 25.87 Favored Pre-proline 0 C--N 1.312 -1.04 0 CA-C-N 114.461 -1.245 . . . . 72.12 108.659 -177.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.592 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 73.3 Cg_endo -73.46 130.06 14.53 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 121.855 1.703 . . . . 72.0 111.892 -176.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -96.27 -172.45 2.54 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.931 -0.766 . . . . 71.32 108.931 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 38' ' ' GLU . 26.3 mtpt -139.77 120.09 13.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.235 0.54 . . . . 65.51 111.138 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 80' ' ' ILE . 29.7 mt -107.34 123.64 48.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.349 -0.841 . . . . 72.22 110.59 174.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.627 HG22 ' HB3' ' A' ' 40' ' ' GLU . 47.8 t -102.28 127.17 56.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.874 -0.603 . . . . 73.13 109.51 172.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.559 HG22 ' CD2' ' A' ' 61' ' ' LEU . 40.7 t -104.02 108.8 25.47 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.091 -0.504 . . . . 54.42 109.913 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.902 ' HB2' HG12 ' A' ' 60' ' ' VAL . 45.5 m-85 -79.58 112.57 16.97 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.986 -0.746 . . . . 73.43 108.986 173.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.74 179.67 16.58 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.639 -0.791 . . . . 32.23 112.218 -177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.524 ' HG2' ' HB2' ' A' ' 45' ' ' ASP . 0.3 OUTLIER -151.56 118.57 5.86 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.34 -0.615 . . . . 74.03 109.34 -176.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.69 107.16 0.56 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.933 -0.576 . . . . 61.52 110.883 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.11 -20.01 4.06 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.584 -0.735 . . . . 64.14 111.366 -175.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 15' ' ' ARG . 60.5 m -87.56 118.94 27.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.869 0.366 . . . . 64.25 110.264 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.6 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 33.4 t60 -71.41 -33.56 69.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.077 -0.51 . . . . 72.34 111.328 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -65.25 -31.01 71.94 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.778 -0.369 . . . . 74.21 110.842 176.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.406 ' O ' HG13 ' A' ' 25' ' ' ILE . 42.9 t -54.97 -47.31 74.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.079 -0.51 . . . . 73.32 110.989 -178.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 13.9 pt-20 -71.16 -32.22 68.65 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.364 -0.38 . . . . 73.25 110.945 -178.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 34.0 mt-10 -71.61 -34.9 70.24 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.074 -0.512 . . . . 72.32 110.522 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.79 ' HG3' ' HB3' ' A' ' 59' ' ' PRO . 87.1 mmm -63.83 -43.04 97.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.902 -0.59 . . . . 74.23 110.123 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.623 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 77.1 mt -54.4 -50.58 56.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 74.4 110.78 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.84 -39.74 86.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.343 -0.39 . . . . 65.34 110.973 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -61.64 -44.0 97.8 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.949 -0.569 . . . . 75.23 110.704 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -66.11 -38.46 88.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.96 -0.564 . . . . 51.54 111.299 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.1 mmm180 -58.2 -41.83 84.86 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.676 0.274 . . . . 72.51 111.574 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.558 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 60.0 t -68.89 -40.49 81.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.856 0.36 . . . . 71.11 111.056 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -33.55 70.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.02 0.438 . . . . 63.43 109.92 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.59 -30.15 69.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.53 -0.759 . . . . 72.03 110.742 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.558 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 52.7 mtmt -69.28 -33.62 73.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.728 -0.669 . . . . 75.23 110.749 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -83.15 -46.06 13.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.619 -0.718 . . . . 73.5 110.281 -177.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.453 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.9 m -135.22 118.24 16.38 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.661 -0.7 . . . . 74.3 109.511 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.1 t-105 -76.99 117.81 18.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.476 0.655 . . . . 63.02 111.447 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -129.34 22.98 5.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.303 -0.862 . . . . 74.22 110.43 177.427 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 19.9 mm-40 57.4 -179.93 0.05 Allowed 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.501 -175.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.401 ' HA ' HD12 ' A' ' 39' ' ' LEU . 11.3 tp -152.55 117.03 4.99 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.877 -0.729 . . . . 73.44 110.778 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.627 ' HB3' HG22 ' A' ' 11' ' ' VAL . 14.9 tt0 -124.41 117.39 24.34 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.872 -0.788 . . . . 60.14 108.872 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 56.3 t -109.04 111.43 36.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.305 -0.407 . . . . 73.03 109.905 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.6 mt -117.86 109.93 29.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 116.062 -0.517 . . . . 73.21 110.741 -175.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.69 124.82 27.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.062 -0.517 . . . . 72.21 110.978 177.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.562 HD12 ' HA ' ' A' ' 51' ' ' THR . 34.7 pt -86.8 -14.55 10.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.56 178.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.524 ' HB2' ' HG2' ' A' ' 15' ' ' ARG . 13.6 t70 -56.51 -34.67 67.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.841 -0.618 . . . . 75.41 111.82 -174.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -91.9 27.41 10.09 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.704 -0.76 . . . . 73.25 113.02 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 22.6 t-20 -152.76 115.66 4.58 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.645 -0.327 . . . . 73.44 110.512 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.69 -34.92 67.9 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.797 0.295 . . . . 73.05 111.797 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 36.5 m80 -69.34 -53.86 17.45 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.801 -0.444 . . . . 64.32 109.801 -177.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 mt -65.79 -39.45 90.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.757 -0.656 . . . . 74.5 111.381 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 95.2 m -54.24 -57.72 10.11 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 120.612 0.244 . . . . 64.33 110.753 178.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 64.2 mtm180 -67.54 -31.02 70.83 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 121.069 -0.252 . . . . 75.24 111.264 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 49' ' ' HIS . 0.5 OUTLIER -67.19 -52.39 41.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.54 -0.3 . . . . 74.41 111.52 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.555 ' HB2' HD13 ' A' ' 44' ' ' ILE . 70.3 m-85 -111.47 19.74 17.9 Favored 'General case' 0 C--O 1.222 -0.343 0 N-CA-C 112.352 0.501 . . . . 73.31 112.352 -173.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.574 ' HB2' ' O ' ' A' ' 51' ' ' THR . 8.8 t30 -59.83 -37.74 80.08 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.224 0.466 . . . . 62.24 110.568 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -103.07 14.11 32.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.7 0.762 . . . . 70.41 109.741 176.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.494 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 14.2 ttm180 -138.44 29.14 2.44 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.897 -0.592 . . . . 60.11 109.648 -176.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.861 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -84.5 -146.42 0.0 OUTLIER Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 118.525 -0.75 . . . . 64.3 109.729 176.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.861 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 35.1 Cg_exo -2.43 70.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.991 0 C-N-CA 122.351 2.034 . . . . 63.21 112.694 -139.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.902 HG12 ' HB2' ' A' ' 13' ' ' TYR . 4.0 p -116.91 139.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 CA-C-N 114.553 -1.203 . . . . 74.5 110.396 -165.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.559 ' CD2' HG22 ' A' ' 12' ' ' VAL . 58.6 mt -103.13 110.6 22.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.985 0.421 . . . . 75.05 110.923 179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.578 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.1 t80 -92.18 120.48 32.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.623 -0.717 . . . . 72.43 109.909 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.97 100.65 9.05 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.815 -0.63 . . . . 71.54 110.981 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.54 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.7 t -79.02 98.83 2.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.336 -0.393 . . . . 54.11 110.291 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 18.1 t-20 168.46 -39.53 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.273 -0.876 . . . . 74.1 108.691 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -125.34 1.87 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.521 -0.763 . . . . 63.12 110.672 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.89 81.43 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.662 -0.699 . . . . 75.42 111.952 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -173.03 149.6 1.88 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 73.53 110.043 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 62' ' ' PHE . 1.9 mp0 -88.07 144.93 26.23 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.851 -0.426 . . . . 74.33 109.851 175.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.4 mt -88.36 -51.33 5.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.014 0.435 . . . . 74.31 110.671 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 44.7 t -150.79 158.84 44.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 70.24 109.898 -177.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.706 ' HB3' HG23 ' A' ' 60' ' ' VAL . 2.2 p80 -136.17 129.43 31.69 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.661 -0.496 . . . . 64.34 109.661 177.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 73.4 m-85 65.47 121.55 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 O-C-N 124.18 0.925 . . . . 72.51 110.472 -173.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 72.1 m-85 69.5 171.75 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.193 -0.912 . . . . 61.43 110.767 -175.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.1 tp -123.24 118.3 27.28 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.751 -0.379 . . . . 72.4 111.83 -169.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -92.64 106.24 18.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.915 -0.584 . . . . 53.13 110.026 173.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.1 m -68.52 -39.42 81.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.012 -0.54 . . . . 45.31 111.534 -176.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.46 -41.11 85.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.945 0.402 . . . . 63.55 111.046 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.4 t -66.52 -41.47 88.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 41.22 111.536 -177.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.598 HD11 HD11 ' A' ' 10' ' ' LEU . 8.4 tp -72.55 -31.67 38.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.188 -0.605 . . . . 63.42 110.022 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.58 78.06 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.748 -0.739 . . . . 64.55 111.554 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.14 -29.83 66.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.757 0.313 . . . . 73.33 111.042 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -87.12 -42.26 13.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.929 0.395 . . . . 74.11 111.556 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.485 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -69.02 -21.18 64.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.065 -0.516 . . . . 74.34 111.95 -174.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.326 -0.452 0 N-CA-C 109.628 -0.508 . . . . 44.13 109.628 176.501 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.6 ttp . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.769 0.318 . . . . 74.02 110.296 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -68.08 115.15 7.24 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.846 -0.798 . . . . 64.33 108.846 174.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -79.05 124.99 28.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.505 0.669 . . . . 71.44 111.072 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -112.4 83.61 1.83 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.664 -0.698 . . . . 74.24 109.582 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -91.8 137.66 21.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.699 -0.682 . . . . 71.01 110.003 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -129.06 153.02 80.27 Favored Pre-proline 0 C--N 1.308 -1.214 0 CA-C-N 115.131 -0.941 . . . . 63.2 109.833 -176.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -75.51 177.94 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.341 2.027 . . . . 64.34 111.729 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 9.4 mpt_? -91.93 -179.1 5.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.322 -0.622 . . . . 72.12 109.322 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.755 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 3.3 tmtp? -142.64 115.17 8.53 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.041 0.448 . . . . 70.03 109.918 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 HD11 ' A' ' 80' ' ' ILE . 79.7 mt -105.66 133.37 50.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.941 -0.572 . . . . 73.2 111.131 178.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.6 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 68.2 t -107.34 127.3 63.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.602 -0.726 . . . . 63.02 109.61 172.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 61' ' ' LEU . 92.4 t -96.64 112.13 28.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 120.953 0.406 . . . . 71.44 110.206 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 1.012 ' HB2' HG23 ' A' ' 60' ' ' VAL . 61.1 m-85 -81.91 111.86 18.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.161 -0.472 . . . . 75.54 109.879 175.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' O ' HG12 ' A' ' 44' ' ' ILE . . . -120.92 -161.72 11.49 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 110.361 -1.096 . . . . 75.42 110.361 176.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.75 ' HG2' HG11 ' A' ' 58' ' ' VAL . 2.1 ptp180 -164.48 -53.52 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 117.692 0.746 . . . . 63.34 112.28 176.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -137.08 -175.19 3.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.606 -0.27 . . . . 71.42 111.068 -169.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -79.0 62.61 3.96 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 116.073 -0.512 . . . . 60.02 113.322 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 m -81.84 134.55 35.43 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.212 -0.662 . . . . 71.12 109.212 173.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.499 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 3.0 t60 -68.48 -38.66 81.23 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.504 -0.478 . . . . 55.52 109.836 -176.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 20' ' ' LEU . 23.3 mt -57.37 -31.62 65.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.439 -0.346 . . . . 62.2 111.499 175.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.443 ' O ' HG13 ' A' ' 25' ' ' ILE . 41.9 t -57.62 -49.5 76.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.452 -0.34 . . . . 75.12 110.426 -178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.4 pt-20 -70.63 -29.2 65.51 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.783 0.325 . . . . 71.12 110.436 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 38.2 mt-10 -70.1 -39.73 75.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.985 0.421 . . . . 73.34 110.151 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 89.9 mmm -64.62 -45.49 86.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.048 -0.524 . . . . 72.24 110.004 174.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 81.2 mt -55.41 -49.64 71.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.261 -0.427 . . . . 71.55 110.285 177.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 30' ' ' VAL . . . -60.03 -42.81 95.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.706 0.289 . . . . 75.32 110.9 178.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.2 m -55.79 -49.08 74.17 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.235 -0.439 . . . . 64.31 110.757 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.467 HD21 HD11 ' A' ' 61' ' ' LEU . 4.2 mm? -67.25 -38.86 85.86 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.155 -0.475 . . . . 73.11 111.155 179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 22.8 mmm180 -61.07 -38.75 87.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.779 0.323 . . . . 64.12 110.987 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.574 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 93.9 t -68.53 -44.28 83.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.258 -0.428 . . . . 63.52 111.101 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.48 -32.22 73.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.153 0.502 . . . . 63.41 109.732 178.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.459 ' HA ' ' O ' ' A' ' 35' ' ' SER . 35.5 tt0 -64.13 -21.64 66.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.598 -0.728 . . . . 71.32 110.404 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 57.7 mtmt -78.45 -11.84 59.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.585 -0.734 . . . . 71.31 110.943 177.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.18 -48.48 4.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.168 0.508 . . . . 73.13 109.716 173.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.473 ' HB3' HD12 ' A' ' 84' ' ' LEU . 21.7 m -133.81 127.99 33.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.405 -0.816 . . . . 73.25 110.209 -177.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -82.22 131.3 35.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.217 0.532 . . . . 74.13 111.354 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.534 ' HB3' HD21 ' A' ' 84' ' ' LEU . 7.5 p90 -140.21 22.01 2.41 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.419 -0.81 . . . . 75.25 110.697 177.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 58.2 -176.08 0.08 Allowed 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.135 -0.484 . . . . 64.21 110.402 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.28 137.03 19.15 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.759 -0.46 . . . . 62.1 109.759 175.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.723 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 4.2 tp10 -136.71 143.42 43.34 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.139 -0.689 . . . . 73.33 109.139 174.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.0 t -127.9 109.52 20.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.999 -0.371 . . . . 73.21 109.999 -178.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.519 HD12 HG11 ' A' ' 11' ' ' VAL . 75.9 mt -123.99 109.85 24.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.309 -0.405 . . . . 54.41 110.881 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.443 HD22 ' C ' ' A' ' 15' ' ' ARG . 10.8 m120 -81.53 111.42 17.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.219 -0.446 . . . . 62.55 110.129 176.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.558 HD13 ' HB2' ' A' ' 54' ' ' TYR . 48.4 pt -76.97 -2.01 4.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 71.31 111.153 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 35.3 t70 -61.96 -32.66 73.11 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.099 -0.501 . . . . 45.22 110.766 -178.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -95.53 0.58 63.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.918 -0.658 . . . . 61.21 112.116 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.68 97.82 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.716 -0.476 . . . . 74.54 109.716 -179.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -58.79 -43.04 90.38 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.735 -0.666 . . . . 54.34 111.276 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -76.08 -30.51 58.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.677 0.275 . . . . 60.45 110.851 -172.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.5 mt -77.17 -26.69 53.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.818 0.342 . . . . 70.03 110.71 176.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.503 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 50.5 m -59.89 -37.68 80.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.177 -0.465 . . . . 71.14 110.635 176.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -56.41 -32.56 64.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.165 0.507 . . . . 73.15 110.706 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.3 mt -91.15 -57.5 2.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.774 -0.648 . . . . 74.22 111.572 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.558 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.6 m-85 -104.51 13.66 31.37 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.116 0.784 . . . . 73.03 113.116 -166.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 51' ' ' THR . 12.6 t30 -52.59 -58.22 7.49 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.341 0.519 . . . . 55.53 111.852 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -90.7 -3.18 57.67 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.023 0.439 . . . . 64.43 111.3 -177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.25 74.52 1.24 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.969 -0.752 . . . . 71.43 108.969 178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.857 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -100.52 -141.17 0.0 OUTLIER Pre-proline 0 N--CA 1.439 -1.01 0 CA-C-O 118.37 -0.824 . . . . 74.13 109.835 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.857 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 77.2 Cg_exo -9.03 71.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.806 0 C-N-CA 122.778 2.318 . . . . 72.34 114.351 -140.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 1.012 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -103.89 136.26 37.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.423 -0.808 . . . . 75.34 111.583 -173.373 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.6 HD23 HG22 ' A' ' 12' ' ' VAL . 96.1 mt -93.32 109.22 20.77 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.488 -0.778 . . . . 63.31 110.216 177.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.6 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 85.0 t80 -92.08 125.5 36.79 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.362 -0.835 . . . . 74.31 109.937 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.537 ' HB3' ' HG3' ' A' ' 68' ' ' LYS . . . -82.64 104.94 13.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.935 -0.575 . . . . 72.24 110.566 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 85.5 t -70.9 154.29 8.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.567 -0.531 . . . . 74.01 109.567 177.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 87.0 m-20 78.98 -38.03 0.2 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.714 0.806 . . . . 62.23 110.145 -174.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.588 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 51.8 mm-40 -87.13 -33.61 19.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.859 -0.61 . . . . 72.43 111.031 175.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 15.8 t70 61.7 66.34 0.85 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.561 0.696 . . . . 65.35 109.905 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.588 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 3.2 ptpp? -160.23 153.51 21.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.294 -0.866 . . . . 75.45 109.992 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.1 mp0 -87.66 144.19 26.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.34 -0.615 . . . . 71.2 109.34 174.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 64.2 mt -109.99 -56.51 2.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.023 0.44 . . . . 74.14 111.291 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 46.6 t -140.76 157.49 45.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.897 -0.592 . . . . 72.52 110.472 -169.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 60' ' ' VAL . 18.3 p-80 -127.63 -171.96 2.56 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.344 -0.613 . . . . 74.34 109.344 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.519 ' O ' ' HB2' ' A' ' 74' ' ' PHE . 13.0 p90 -48.88 144.27 4.74 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.606 0.241 . . . . 71.02 111.548 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.519 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 36.3 m-85 71.1 90.15 0.1 Allowed 'General case' 0 C--O 1.236 0.355 0 O-C-N 124.101 0.875 . . . . 65.22 108.827 -165.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.72 126.2 25.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.659 -1.155 . . . . 74.14 111.522 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -75.15 -35.96 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.763 -0.653 . . . . 75.13 110.238 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.3 m 72.37 -48.19 0.68 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.099 -0.955 . . . . 74.23 112.278 178.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -67.45 -50.6 58.49 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.819 0.303 . . . . 51.12 111.819 -175.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.6 -51.24 75.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 111.782 0.29 . . . . 54.33 111.782 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.793 HD11 HD23 ' A' ' 84' ' ' LEU . 7.1 tp -68.47 -29.57 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 119.834 -0.746 . . . . 74.15 110.298 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.04 -41.35 97.26 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.684 -0.77 . . . . 73.03 111.582 176.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.37 -26.38 68.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.28 0.562 . . . . 62.22 110.633 176.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.428 ' CE2' ' HG2' ' A' ' 8' ' ' ARG . 85.1 t80 -88.0 -50.37 6.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.796 -0.638 . . . . 73.32 111.52 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.793 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -76.52 -39.18 53.74 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.335 0.495 . . . . 73.54 112.335 -172.123 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.7 p . . . . . 0 C--N 1.324 -0.516 0 C-N-CA 120.778 -0.369 . . . . 74.52 111.345 -173.919 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttp . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.237 -0.283 . . . . 61.55 110.237 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -179.58 127.92 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.29 0.567 . . . . 60.35 111.286 -177.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -129.59 78.17 1.83 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.31 -0.996 . . . . 71.44 108.31 169.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.4 88.91 6.98 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.588 0.709 . . . . 75.33 111.171 -172.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.6 m -104.29 129.85 55.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.036 -0.984 . . . . 73.24 109.126 172.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 35.8 mt-10 -132.18 156.45 80.09 Favored Pre-proline 0 C--N 1.313 -0.994 0 CA-C-N 116.217 -0.447 . . . . 74.15 110.665 -171.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 59.3 Cg_endo -69.4 173.62 10.39 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.754 2.303 . . . . 72.35 112.896 -175.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.529 ' HG3' ' HA ' ' A' ' 84' ' ' LEU . 0.5 OUTLIER -108.26 -170.23 1.64 Allowed 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.042 -0.725 . . . . 73.02 109.042 178.093 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 83.6 tttt -146.58 128.68 15.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.081 0.467 . . . . 74.32 110.57 171.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.602 HD11 HD11 ' A' ' 80' ' ' ILE . 80.6 mt -114.96 129.82 56.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.599 -0.728 . . . . 62.41 110.212 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.7 t -107.63 126.36 63.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 116.061 -0.518 . . . . 54.32 109.704 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.575 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 55.8 t -106.09 108.66 25.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.284 0.564 . . . . 63.13 110.058 176.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.674 ' HB2' HG23 ' A' ' 60' ' ' VAL . 96.1 m-85 -81.68 110.62 17.2 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 72.43 109.069 174.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -113.95 171.06 13.58 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.448 -0.882 . . . . 51.22 113.019 -173.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HB2' HG11 ' A' ' 58' ' ' VAL . 45.5 ttt180 -159.32 21.7 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.386 -0.968 . . . . 74.22 108.386 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 62.07 -97.64 0.07 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 114.248 -1.342 . . . . 60.24 110.191 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.47 -89.05 1.31 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.898 -0.668 . . . . 72.43 113.103 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 10.3 t -143.07 -167.69 2.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.77 0.319 . . . . 54.12 110.944 -173.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.488 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 22.5 m-70 -69.15 -30.52 68.78 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 113.047 0.758 . . . . 73.14 113.047 -169.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 73' ' ' TYR . 32.4 mt -53.47 -31.29 45.08 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 120.873 -0.331 . . . . 64.11 111.605 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.473 ' O ' HG13 ' A' ' 25' ' ' ILE . 27.1 t -60.14 -48.45 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.492 -0.322 . . . . 72.22 110.912 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.3 pt-20 -73.95 -32.86 63.67 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.754 0.311 . . . . 73.41 110.762 -178.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.09 -41.14 96.11 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.201 0.524 . . . . 75.34 110.06 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.619 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 89.4 mmm -65.27 -46.34 80.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.718 -0.674 . . . . 71.01 110.803 176.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.481 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 83.8 mt -56.55 -48.2 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.335 -0.393 . . . . 64.34 111.497 -178.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.17 92.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.068 0.461 . . . . 62.14 110.936 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.6 m -64.67 -39.11 93.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.866 -0.606 . . . . 61.13 111.272 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 24' ' ' MET . 83.3 mt -63.41 -38.72 92.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 74.15 110.95 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 13.3 mmm180 -62.87 -42.72 99.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 61.24 110.913 -177.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.448 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 68.1 t -71.28 -42.48 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.376 -0.375 . . . . 74.45 110.983 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 0.6 OUTLIER -66.02 -31.87 73.02 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.048 -0.353 . . . . 71.31 110.048 -179.657 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.44 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -57.99 -28.94 64.86 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.965 0.412 . . . . 75.4 110.907 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 48.4 mtmt -79.86 -12.49 59.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 72.23 110.868 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -103.63 -41.73 5.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 73.43 109.748 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.418 ' HB3' HD12 ' A' ' 84' ' ' LEU . 43.5 m -148.52 119.13 7.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.089 -0.959 . . . . 71.13 109.13 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 62.9 t-105 -72.28 129.58 38.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 64.24 111.239 -176.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 p90 -139.53 21.7 2.53 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.67 -0.695 . . . . 72.11 110.932 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.561 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 22.9 mm-40 59.15 -177.62 0.09 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.94 0.4 . . . . 65.11 110.309 -177.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.44 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 7.0 tp -154.3 109.96 3.18 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.485 -0.486 . . . . 64.32 110.476 168.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -114.75 117.87 31.98 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.425 -0.583 . . . . 73.34 109.425 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.7 t -110.84 110.3 31.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.902 -0.59 . . . . 75.12 110.249 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.1 mt -119.6 111.26 32.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.167 -0.47 . . . . 64.33 110.544 -176.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 17.2 m120 -81.16 113.95 19.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.25 -0.432 . . . . 61.33 110.175 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 51' ' ' THR . 33.8 pt -79.4 0.01 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.926 -0.579 . . . . 73.53 111.964 -173.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.2 -39.52 90.52 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.088 0.471 . . . . 73.34 111.062 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -85.03 8.73 68.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.777 -0.725 . . . . 65.1 112.753 -178.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -137.71 97.48 3.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.735 0.268 . . . . 74.52 110.557 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 48' ' ' GLU . 3.9 mp0 -54.22 -33.94 59.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.282 -0.417 . . . . 63.14 110.456 178.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.3 m170 -57.19 -48.95 77.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.5 -0.773 . . . . 71.23 110.064 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' A' ' 53' ' ' LEU . 90.8 mt -77.84 -26.8 49.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.811 -0.632 . . . . 72.41 111.087 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.591 ' HA ' HD12 ' A' ' 44' ' ' ILE . 85.5 m -56.37 -48.97 75.76 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.296 -0.411 . . . . 42.32 111.24 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -66.39 -31.7 72.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.838 0.351 . . . . 75.53 110.836 -176.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 50' ' ' LEU . 71.0 mt -64.32 -48.49 75.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.888 -0.596 . . . . 61.12 111.314 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 44' ' ' ILE . 81.7 m-85 -119.08 24.84 10.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.43 -0.35 . . . . 72.41 111.905 -172.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 51' ' ' THR . 28.1 t-20 -62.36 120.72 11.57 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 121.023 -0.271 . . . . 73.15 110.43 177.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' ASN . 20.8 t70 71.66 -3.49 2.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.752 0.786 . . . . 62.4 110.614 -176.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -115.43 32.91 5.76 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.195 -0.669 . . . . 60.43 109.195 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.782 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -82.51 -140.85 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.662 0 CA-C-O 118.636 -0.697 . . . . 64.34 111.071 -176.424 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.782 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 28.1 Cg_exo -3.89 69.33 0.0 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.729 0 C-N-CA 122.536 2.157 . . . . 63.51 113.278 -139.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.674 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -92.08 131.41 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-N 114.641 -1.163 . . . . 73.44 110.837 -172.215 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 10' ' ' LEU . 2.3 tm? -97.65 101.99 13.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.591 -0.892 . . . . 64.32 108.591 174.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.2 t80 -95.29 124.55 39.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.866 -1.061 . . . . 72.53 110.435 -175.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 106.17 17.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.052 -0.522 . . . . 63.12 110.58 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.49 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 58.3 t -67.72 152.85 9.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.558 -0.534 . . . . 71.33 109.558 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 92.8 m-20 76.74 -39.01 0.33 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.528 0.731 . . . . 64.03 110.551 -176.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.86 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . 21.2 mm-40 -76.73 -35.98 57.44 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.44 -0.578 . . . . 74.54 109.44 170.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 0.5 OUTLIER 61.51 41.7 12.24 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.89 -1.05 . . . . 74.13 109.479 179.509 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.86 ' HG2' ' HB3' ' A' ' 66' ' ' GLU . 1.2 ptpp? -142.15 164.5 30.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.036 -0.984 . . . . 73.1 110.471 -178.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -87.47 134.68 33.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.209 -0.451 . . . . 75.34 110.079 174.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.27 -49.99 6.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.255 -0.646 . . . . 71.25 109.255 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 15.9 t -168.15 165.97 13.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.984 -0.747 . . . . 52.51 108.984 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.607 ' HD2' ' CD2' ' A' ' 73' ' ' TYR . 49.5 p-80 -144.17 143.99 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 121.202 -0.199 . . . . 63.54 110.661 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.607 ' CD2' ' HD2' ' A' ' 72' ' ' HIS . 64.3 m-85 74.15 -34.65 0.28 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 124.129 0.893 . . . . 72.23 111.785 -176.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -126.51 165.48 19.05 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.616 -0.513 . . . . 54.14 109.616 -176.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.7 tp -119.71 103.37 9.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.987 0.422 . . . . 72.41 111.017 -174.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -87.29 96.63 10.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.812 -0.631 . . . . 64.21 109.567 174.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.514 ' HA ' HG22 ' A' ' 80' ' ' ILE . 8.6 m -61.56 -30.1 70.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.674 -0.693 . . . . 72.21 111.472 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -64.18 -42.53 96.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.392 -0.367 . . . . 74.12 110.558 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 71.0 t -75.52 -44.37 41.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.357 -0.383 . . . . 71.21 111.359 -177.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.602 HD11 HD11 ' A' ' 10' ' ' LEU . 8.0 tp -66.44 -34.32 69.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.358 -0.537 . . . . 72.23 110.269 179.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.08 91.49 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.882 -0.675 . . . . 74.04 111.779 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.77 -33.38 75.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 64.14 111.038 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -87.35 -40.19 14.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.971 -0.559 . . . . 74.23 111.88 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.604 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -76.8 2.41 14.52 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.699 0.629 . . . . 71.24 112.699 -171.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--N 1.319 -0.729 0 N-CA-C 110.224 -0.288 . . . . 63.32 110.224 176.342 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.448 0.642 . . . . 73.35 110.066 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -146.13 13.82 1.28 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.182 -0.463 . . . . 53.31 110.619 -173.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.12 100.34 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.769 0.668 . . . . 70.35 110.551 -174.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -84.92 96.24 9.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.073 0.463 . . . . 65.21 110.229 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.5 m -86.07 131.31 34.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.908 -0.587 . . . . 61.12 110.64 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.589 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 12.0 pt-20 -60.5 162.35 11.56 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 114.859 -1.064 . . . . 55.01 111.126 -178.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 58.9 Cg_endo -71.98 144.74 43.51 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.306 2.004 . . . . 73.1 112.312 -177.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.569 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 0.0 OUTLIER -111.9 138.79 48.04 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.82 -0.807 . . . . 72.5 108.82 175.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.586 ' HE2' ' HB2' ' A' ' 40' ' ' GLU . 77.9 tttt -88.05 149.79 23.77 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.281 0.562 . . . . 54.51 112.501 -167.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 80' ' ' ILE . 75.2 mt -115.45 131.78 56.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.274 -0.876 . . . . 75.55 110.717 174.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.591 HG23 ' CG2' ' A' ' 64' ' ' VAL . 52.5 t -104.33 133.81 47.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 75.22 109.42 172.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.481 HG22 HD23 ' A' ' 61' ' ' LEU . 21.8 t -98.86 105.7 17.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 C-N-CA 120.165 -0.614 . . . . 75.54 109.426 172.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.75 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 23.6 m-85 -72.13 154.42 41.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 109.189 -0.671 . . . . 73.12 109.189 174.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.581 ' HA2' HG12 ' A' ' 58' ' ' VAL . . . 156.01 -145.27 11.98 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.248 -0.977 . . . . 64.15 111.963 175.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.619 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 8.9 ptm180 -161.03 177.27 10.5 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.447 -0.575 . . . . 73.42 109.447 176.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -77.88 111.48 13.75 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.113 0.482 . . . . 75.23 111.656 -170.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 123.71 63.43 0.2 Allowed Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.852 -0.613 . . . . 64.12 112.669 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 73.4 m -148.38 115.34 6.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 71.33 110.814 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.455 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 57.1 t60 -70.91 -39.14 72.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.359 -0.382 . . . . 60.11 111.388 -176.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.441 HD23 ' OE2' ' A' ' 23' ' ' GLU . 15.8 mt -59.72 -31.18 69.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.877 0.37 . . . . 62.22 110.986 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.586 ' O ' HG13 ' A' ' 25' ' ' ILE . 35.3 t -61.04 -45.89 92.93 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.591 -0.522 . . . . 60.03 109.591 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.416 ' O ' ' HB ' ' A' ' 25' ' ' ILE . 30.2 mt-10 -60.73 -47.75 84.9 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.853 -0.612 . . . . 53.22 110.733 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 31.9 mt-10 -63.22 -38.3 90.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.419 -0.809 . . . . 73.1 111.619 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.566 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 45.5 mtp -72.13 -27.94 62.94 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.667 -0.413 . . . . 74.4 110.852 177.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 21' ' ' CYS . 67.6 mt -59.12 -45.91 92.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.986 -0.375 . . . . 70.45 109.986 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.97 -41.73 96.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.088 -0.505 . . . . 64.31 110.746 177.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 m -65.18 -42.38 93.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.009 -0.541 . . . . 73.33 110.719 178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 24' ' ' MET . 79.0 mt -67.27 -31.95 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 74.04 111.101 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 9.6 mmm-85 -62.11 -44.02 97.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.07 0.462 . . . . 71.54 110.156 175.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.57 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 57.9 t -62.97 -41.46 92.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 53.44 110.492 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -68.1 -33.86 75.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.359 -0.382 . . . . 71.23 110.284 179.349 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.472 ' HA ' ' O ' ' A' ' 35' ' ' SER . 39.8 mt-30 -61.23 -20.86 63.3 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.754 0.312 . . . . 61.31 111.484 177.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.57 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 50.8 mtmt -78.74 -17.72 55.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.168 0.509 . . . . 71.42 110.687 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -99.09 -45.98 5.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.618 -0.719 . . . . 74.14 109.563 176.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 25.5 m -144.88 122.83 12.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.367 -0.833 . . . . 71.11 109.559 -178.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -78.68 135.33 37.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.642 0.258 . . . . 72.53 110.651 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 8.2 p90 -146.01 14.23 1.32 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.487 -0.324 . . . . 74.11 111.561 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.559 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 16.7 mt-10 54.9 -174.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.626 0.726 . . . . 53.52 111.203 -175.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 39' ' ' LEU . 6.0 tp -150.85 109.8 3.89 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.83 -0.623 . . . . 73.45 110.351 174.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.586 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 6.2 tp10 -108.7 147.17 32.33 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.517 -0.31 . . . . 75.24 110.225 -178.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.9 t -123.65 125.62 71.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.605 -0.517 . . . . 73.45 109.605 176.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.53 HD12 HG11 ' A' ' 11' ' ' VAL . 77.7 mt -135.43 119.87 26.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.919 0.39 . . . . 61.52 110.804 -179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.619 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 42.6 m-80 -80.66 129.61 34.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 61.14 111.311 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.534 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.0 pt -88.56 -15.48 9.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.948 -0.569 . . . . 71.14 110.323 175.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -48.48 -45.67 37.16 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.283 -0.872 . . . . 74.14 112.472 -172.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -87.78 -0.58 83.66 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.654 -0.784 . . . . 64.32 113.276 -176.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 50' ' ' LEU . 51.8 m-80 -110.42 111.82 23.34 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.165 -0.309 . . . . 72.32 110.165 -177.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -56.28 -47.29 78.9 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.995 -0.548 . . . . 72.2 111.721 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -70.75 -37.9 73.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.69 0.281 . . . . 74.3 110.475 -174.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 47' ' ' ASN . 69.3 mt -69.22 -33.07 72.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 54.43 110.54 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.475 ' HA ' HD12 ' A' ' 44' ' ' ILE . 94.3 m -57.69 -56.76 17.72 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.188 -0.46 . . . . 51.25 110.475 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.822 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.54 -29.9 68.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.753 0.279 . . . . 75.15 111.753 -178.437 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 85.6 mt -75.76 -48.13 23.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.466 0.543 . . . . 71.32 112.466 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.534 ' HB2' HD13 ' A' ' 44' ' ' ILE . 51.0 m-85 -122.83 7.87 9.37 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 113.621 0.971 . . . . 70.34 113.621 -167.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.8 t-20 -59.86 -50.42 73.86 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 118.746 0.703 . . . . 74.24 111.766 -176.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -77.12 -20.58 55.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.907 -0.588 . . . . 62.54 111.169 -175.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -128.63 75.15 1.61 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.303 -0.628 . . . . 70.43 109.303 175.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.869 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -83.19 -142.92 0.0 OUTLIER Pre-proline 0 N--CA 1.438 -1.061 0 CA-C-O 117.823 -1.084 . . . . 64.51 109.335 176.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.869 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 94.7 Cg_exo -10.96 101.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.954 0 C-N-CA 122.32 2.013 . . . . 74.31 113.787 -141.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.621 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -129.43 142.82 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 123.427 0.455 . . . . 52.12 110.98 -176.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 1.047 ' HG ' ' HD2' ' A' ' 72' ' ' HIS . 22.7 mt -88.11 123.3 32.63 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.094 0.473 . . . . 75.03 111.539 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.509 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 89.7 t80 -105.28 129.9 53.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.083 -0.962 . . . . 74.51 110.296 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.423 ' HB1' ' CZ ' ' A' ' 83' ' ' TYR . . . -80.43 104.07 10.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.165 -0.47 . . . . 53.03 110.926 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.591 ' CG2' HG23 ' A' ' 11' ' ' VAL . 46.9 t -80.79 81.78 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.964 0.412 . . . . 75.21 110.668 -177.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 30.5 t-20 172.92 -59.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.124 -0.944 . . . . 64.22 108.963 177.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -90.05 -7.9 52.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.554 -0.748 . . . . 73.1 110.35 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.4 t70 60.58 78.79 0.27 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.522 0.677 . . . . 74.44 111.395 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -171.42 148.42 2.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.486 -0.779 . . . . 74.11 110.932 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -78.2 137.69 38.28 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.748 -0.464 . . . . 52.34 109.748 174.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 57.8 mt -98.97 -82.41 0.43 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.9 0.381 . . . . 73.42 110.447 178.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.402 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 45.6 t -166.37 148.59 6.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 64.05 109.96 -177.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 1.047 ' HD2' ' HG ' ' A' ' 61' ' ' LEU . 4.9 t-80 -146.28 -170.54 3.52 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.483 -0.562 . . . . 75.51 109.483 176.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 55.5 m-85 101.39 -75.74 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.306 1.443 . . . . 72.44 111.412 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -125.56 8.03 7.65 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.174 -0.21 . . . . 72.24 111.272 -176.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.7 tp 71.88 122.51 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.972 0.795 . . . . 64.43 111.913 177.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.402 ' OD1' ' HB3' ' A' ' 71' ' ' CYS . 6.1 p-10 -85.56 -40.3 16.44 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.677 -0.692 . . . . 64.33 110.894 178.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.4 m 61.35 21.17 11.75 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.89 -0.596 . . . . 53.43 111.242 -177.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -127.24 -53.0 1.39 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.355 0.598 . . . . 73.24 110.354 -175.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.3 t -75.76 -42.93 40.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.514 -0.767 . . . . 72.25 109.904 178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.625 HD11 HD23 ' A' ' 84' ' ' LEU . 7.7 tp -66.05 -31.62 54.49 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.239 0 N-CA-C 109.604 -0.517 . . . . 41.02 109.604 174.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -66.6 -30.14 75.9 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.824 -0.703 . . . . 62.21 111.717 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -77.57 -27.62 51.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.086 0.469 . . . . 73.45 110.505 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.569 ' CE2' ' HG3' ' A' ' 8' ' ' ARG . 69.4 t80 -87.35 -45.41 10.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 65.1 111.817 -177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.625 HD23 HD11 ' A' ' 80' ' ' ILE . 0.3 OUTLIER -74.9 -8.51 56.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.142 -0.481 . . . . 71.11 111.783 -172.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.8 m . . . . . 0 C--N 1.322 -0.6 0 N-CA-C 109.815 -0.439 . . . . 65.24 109.815 175.082 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.5 mmt . . . . . 0 N--CA 1.478 0.936 0 N-CA-C 109.858 -0.423 . . . . 63.33 109.858 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -87.01 90.85 8.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.865 -0.421 . . . . 72.42 109.865 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -79.85 81.63 6.08 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.495 178.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -69.54 110.63 4.89 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.37 -0.832 . . . . 64.14 108.89 174.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.1 m -67.43 158.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 122.006 0.908 . . . . 74.15 112.539 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -82.24 156.85 68.88 Favored Pre-proline 0 C--N 1.312 -1.052 0 CA-C-N 113.869 -1.514 . . . . 73.42 109.994 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -86.83 174.4 5.6 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 122.435 2.09 . . . . 72.13 112.903 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD2' ' N ' ' A' ' 8' ' ' ARG . 2.0 mpt_? -107.58 -176.87 3.19 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.258 -1.015 . . . . 72.14 108.258 176.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.644 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 2.9 tmtp? -150.33 132.34 15.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.415 -0.587 . . . . 72.11 109.415 175.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.587 HD13 HD11 ' A' ' 61' ' ' LEU . 92.7 mt -127.77 138.96 52.92 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 63.22 110.57 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.51 HG22 ' HB3' ' A' ' 40' ' ' GLU . 77.0 t -114.88 137.84 47.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 62.31 110.08 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.608 HG22 HD23 ' A' ' 61' ' ' LEU . 86.0 t -110.14 113.48 44.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.997 0.427 . . . . 73.54 110.18 176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.969 ' HB2' HG23 ' A' ' 60' ' ' VAL . 95.2 m-85 -87.11 128.33 35.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.929 -0.767 . . . . 73.52 108.929 174.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.526 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -172.82 -163.15 26.12 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.188 -1.006 . . . . 64.33 111.91 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.539 ' HA ' ' OD1' ' A' ' 43' ' ' ASN . 13.1 ptm180 -150.69 132.22 14.77 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.369 -0.604 . . . . 73.05 109.369 175.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.49 118.62 7.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.674 -0.694 . . . . 71.03 111.042 -174.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.06 -20.68 1.94 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.38 -0.827 . . . . 64.2 111.601 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.3 p -96.43 128.83 43.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.795 0.331 . . . . 74.24 110.266 177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -69.33 -33.73 73.57 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.213 0.449 . . . . 74.42 112.213 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 73' ' ' TYR . 20.4 mt -58.61 -32.02 68.6 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.758 0.313 . . . . 75.32 111.258 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.86 -42.38 93.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.442 -0.345 . . . . 65.41 110.265 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.08 -45.49 91.85 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.111 -0.495 . . . . 74.11 110.386 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.452 ' OE2' HD23 ' A' ' 20' ' ' LEU . 45.6 mt-10 -61.89 -40.08 94.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.443 -0.799 . . . . 74.01 111.144 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.535 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.6 mtp -68.72 -49.19 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.241 -0.436 . . . . 62.52 110.698 177.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -58.77 -47.64 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-N 116.717 -0.22 . . . . 70.01 111.432 -178.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.5 -36.68 74.16 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.094 0.473 . . . . 53.23 111.076 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.6 m -69.72 -41.44 75.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.873 -0.603 . . . . 63.42 110.66 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 24' ' ' MET . 86.1 mt -66.66 -34.32 77.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.301 -0.408 . . . . 74.44 111.018 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -61.55 -41.84 97.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.34 111.236 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.71 -37.56 43.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.866 0.365 . . . . 75.14 110.596 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' HE2' ' A' ' 37' ' ' PHE . 1.5 mt -64.48 -31.93 73.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.171 -0.468 . . . . 71.2 110.887 178.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.584 ' NE2' ' HB2' ' A' ' 39' ' ' LEU . 32.3 mt-30 -52.52 -34.52 50.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.123 -0.49 . . . . 71.31 111.704 176.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -73.86 -23.97 59.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 72.52 111.357 -176.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -93.65 -42.59 9.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.397 0.618 . . . . 73.23 109.965 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB2' HD13 ' A' ' 84' ' ' LEU . 69.9 m -143.54 104.03 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.924 -1.035 . . . . 73.43 109.198 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 58.7 t-105 -69.27 129.79 40.8 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.898 0.38 . . . . 71.44 111.702 -174.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 30.4 p90 -142.12 18.18 2.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.777 -0.647 . . . . 75.14 111.596 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 59.5 -179.2 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.032 0.444 . . . . 75.1 110.402 -177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.584 ' HB2' ' NE2' ' A' ' 32' ' ' GLN . 6.9 tp -153.14 132.19 12.6 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 120.099 -0.641 . . . . 72.33 110.808 170.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.563 ' HB2' ' HE2' ' A' ' 9' ' ' LYS . 7.7 tt0 -136.76 118.19 14.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.551 -0.537 . . . . 72.31 109.551 178.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -107.1 115.82 49.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.525 -0.546 . . . . 71.02 109.525 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.8 mt -115.83 119.69 62.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.775 -175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.539 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 12.0 m-80 -78.23 117.37 19.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.872 -0.604 . . . . 74.43 111.39 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.462 HG22 HD13 ' A' ' 50' ' ' LEU . 23.9 pt -81.01 -7.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 73.33 109.352 174.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -37.69 -46.97 0.94 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.25 -1.341 . . . . 64.15 113.329 -177.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.86 32.41 6.93 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.269 -0.967 . . . . 70.33 113.933 -175.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -139.08 100.28 3.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.069 0.435 . . . . 71.31 110.585 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HA ' ' HB ' ' A' ' 51' ' ' THR . 3.7 mp0 -55.38 -33.78 63.74 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.103 0.409 . . . . 73.12 112.103 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -56.89 -45.22 82.74 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 110.09 -0.337 . . . . 60.32 110.09 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.462 HD13 HG22 ' A' ' 44' ' ' ILE . 80.2 mt -78.64 -39.56 36.65 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.179 -0.464 . . . . 70.13 110.471 177.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.501 ' HB ' ' HA ' ' A' ' 48' ' ' GLU . 88.0 m -56.09 -54.03 49.92 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.194 -0.457 . . . . 54.53 111.679 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -59.06 -30.55 68.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.981 0.42 . . . . 74.21 110.972 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.9 mt -77.05 -53.82 7.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.078 -0.51 . . . . 55.32 111.906 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.451 ' HB2' HD13 ' A' ' 44' ' ' ILE . 59.3 m-85 -116.27 -0.2 12.68 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.487 1.292 . . . . 74.24 114.487 -165.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -59.35 -39.91 84.7 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 119.843 1.202 . . . . 74.41 111.163 -176.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -84.65 -14.42 48.65 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.792 -0.64 . . . . 74.24 110.951 178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.412 ' HG3' ' CE2' ' A' ' 73' ' ' TYR . 13.0 ttm180 -143.97 54.12 1.3 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 109.315 -0.624 . . . . 74.3 109.315 -167.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.584 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -80.26 -102.66 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.522 0 CA-C-O 118.444 -0.789 . . . . 72.34 111.069 -172.206 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.584 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 16.6 Cg_exo -23.17 75.06 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 122.567 2.178 . . . . 65.04 113.693 -145.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.969 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -102.05 115.51 44.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.619 -0.719 . . . . 75.43 111.251 -169.229 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.608 HD23 HG22 ' A' ' 12' ' ' VAL . 3.0 tm? -89.19 110.25 21.03 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.572 -0.74 . . . . 61.34 109.587 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -92.25 127.15 37.63 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.111 -0.95 . . . . 72.33 110.693 -176.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.28 95.83 7.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.425 -0.807 . . . . 65.3 111.211 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.527 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 42.2 t -77.63 90.76 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.3 0.572 . . . . 72.21 109.487 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 22.8 t-20 172.19 -46.33 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.844 -1.071 . . . . 70.1 108.659 -173.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -124.05 -2.59 8.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.937 -1.029 . . . . 64.24 109.928 -178.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 58.71 78.74 0.24 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.098 -0.955 . . . . 71.1 112.035 176.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -174.33 -179.41 1.59 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.39 -0.823 . . . . 75.32 110.332 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -95.09 141.78 28.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.45 -0.341 . . . . 62.22 110.777 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.1 mt -96.02 -53.9 3.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.388 0.613 . . . . 73.31 109.559 170.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 42.7 t -156.77 155.47 31.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.312 -0.858 . . . . 71.44 109.374 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 0.5 OUTLIER -145.09 163.8 33.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.568 -0.287 . . . . 60.25 110.382 179.253 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.503 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 62.5 m-85 74.55 -56.63 0.63 Allowed 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.114 0.884 . . . . 71.5 110.951 -174.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -129.93 -161.95 1.16 Allowed 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.007 -1.108 . . . . 71.14 108.007 -175.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.8 tp -129.85 113.48 14.71 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.079 -0.648 . . . . 54.41 111.886 -175.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -86.09 86.07 7.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.082 -0.71 . . . . 73.32 109.082 169.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.7 m -59.03 -28.23 66.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 64.22 111.381 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -72.46 -37.4 68.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.193 -0.458 . . . . 75.35 110.908 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 40.5 t -70.89 -46.59 67.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.193 -0.458 . . . . 70.33 110.977 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.512 HD11 HD11 ' A' ' 10' ' ' LEU . 6.9 tp -68.74 -28.18 38.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.346 -0.541 . . . . 64.42 109.992 177.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.78 -30.64 78.26 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 111.448 -0.661 . . . . 72.52 111.448 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.3 -33.03 64.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.187 0.517 . . . . 64.11 110.377 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -80.41 -51.42 8.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.96 -0.563 . . . . 71.35 111.038 179.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.558 HD13 ' HB2' ' A' ' 35' ' ' SER . 13.3 mt -64.87 -50.93 64.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.707 -0.679 . . . . 62.24 111.516 -177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--N 1.327 -0.391 0 O-C-N 123.576 0.548 . . . . 62.2 111.396 -172.943 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.8 ttp . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 120.671 0.272 . . . . 73.31 110.801 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -81.24 -54.55 5.4 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.042 -0.725 . . . . 72.54 109.042 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.482 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 48.3 t30 176.01 -84.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 107.956 -1.127 . . . . 75.13 107.956 176.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 24.8 tt0 167.16 80.15 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.444 1.09 . . . . 74.34 108.829 170.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.2 m -95.72 163.41 2.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.671 -0.492 . . . . 61.41 109.671 176.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.562 ' HB3' ' HD2' ' A' ' 7' ' ' PRO . 34.4 mt-10 -132.84 158.53 75.55 Favored Pre-proline 0 C--N 1.31 -1.114 0 CA-C-N 115.518 -0.764 . . . . 73.2 109.748 -176.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' A' ' 6' ' ' GLU . 45.3 Cg_endo -62.34 158.67 39.19 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.654 2.236 . . . . 71.23 113.329 -169.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.2 mmp_? -99.2 -164.36 1.12 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.935 -0.765 . . . . 54.43 108.935 175.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.965 ' HB3' ' HB ' ' A' ' 64' ' ' VAL . 4.3 tmtp? -149.76 128.87 12.73 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.544 -0.462 . . . . 70.32 110.858 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 37' ' ' PHE . 28.4 mt -116.78 138.67 51.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 64.44 111.294 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 40' ' ' GLU . 41.2 t -124.34 136.41 60.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.701 -0.681 . . . . 63.32 110.131 175.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.579 HG22 HD23 ' A' ' 61' ' ' LEU . 78.4 t -108.35 120.42 59.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.688 -0.486 . . . . 74.44 109.688 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -83.41 97.43 8.95 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 109.688 -0.486 . . . . 74.52 109.688 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.18 -176.12 14.3 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.018 -1.087 . . . . 52.42 112.696 -174.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.748 ' HG2' HG11 ' A' ' 58' ' ' VAL . 5.2 ptm180 -158.28 125.44 4.98 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.896 -0.409 . . . . 74.42 109.896 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 55.3 -154.99 0.28 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.963 -0.562 . . . . 70.43 111.592 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -99.78 145.37 17.41 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.725 -0.75 . . . . 74.53 112.762 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.407 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . 51.2 t -156.28 142.81 18.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.431 -0.581 . . . . 75.23 109.431 177.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 18.4 m170 -60.38 -48.8 80.19 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 62.5 111.772 -175.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -34.65 78.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.416 -0.356 . . . . 73.12 110.699 -175.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 18' ' ' CYS . 84.2 m -64.7 -40.63 95.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.39 . . . . 43.13 110.493 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -61.93 -40.5 95.73 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.038 -0.528 . . . . 74.03 110.218 176.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 19' ' ' HIS . 35.9 mt-10 -64.73 -36.39 84.14 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.726 -0.67 . . . . 71.12 110.942 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.574 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 82.6 mtp -67.26 -44.69 78.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.466 -0.334 . . . . 72.43 110.432 176.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.63 -47.39 82.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 120.821 0.343 . . . . 74.24 110.897 178.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.92 87.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.112 -0.495 . . . . 64.03 110.61 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -64.89 -42.33 94.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 71.21 110.887 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 24' ' ' MET . 95.9 mt -59.31 -45.59 90.89 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 116.164 -0.471 . . . . 60.42 110.569 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 28.1 mmm180 -57.73 -42.63 84.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.39 -0.368 . . . . 73.05 111.255 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 98.8 t -64.3 -45.41 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.287 -0.415 . . . . 45.32 111.137 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.95 -32.96 65.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.914 0.388 . . . . 62.41 110.146 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 28' ' ' LEU . 46.8 tt0 -62.78 -26.77 68.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.846 -0.616 . . . . 74.21 110.633 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 47.9 mtmt -63.36 -42.5 98.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.771 -0.65 . . . . 74.21 110.485 173.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -79.06 -37.61 38.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.056 -0.974 . . . . 64.04 110.639 -174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.632 ' HB3' HD12 ' A' ' 84' ' ' LEU . 46.1 m -145.66 124.68 12.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.527 -0.76 . . . . 75.23 109.628 -179.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t-105 -83.72 119.49 24.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.312 0.577 . . . . 74.31 111.041 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.593 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 1.5 p90 -130.96 20.63 4.95 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.536 -0.756 . . . . 75.24 110.926 179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 9.8 mt-10 53.8 -176.83 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.349 0.595 . . . . 75.1 111.027 -174.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.515 HD11 HD13 ' A' ' 28' ' ' LEU . 7.2 tp -152.17 134.9 15.46 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.186 -0.461 . . . . 72.21 110.031 173.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.675 ' HB3' HG22 ' A' ' 11' ' ' VAL . 10.3 tp10 -136.61 143.04 43.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.116 -0.493 . . . . 54.11 110.195 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 60.2 t -125.75 107.4 17.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.05 -0.722 . . . . 62.24 109.05 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.494 HD12 HG11 ' A' ' 11' ' ' VAL . 62.4 mt -107.86 116.28 50.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.721 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -75.92 106.67 7.63 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.344 -0.844 . . . . 73.33 110.251 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 35.4 pt -80.17 -9.83 12.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.62 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.59 -42.3 23.61 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.245 -0.889 . . . . 62.03 112.652 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.89 21.06 45.82 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.578 -0.82 . . . . 73.23 113.269 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 19.8 t-20 -129.72 119.62 23.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.028 0.414 . . . . 71.21 110.607 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.23 -20.66 60.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.139 -0.482 . . . . 72.14 111.929 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.402 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 26.8 m80 -77.6 -54.77 6.0 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.186 0.517 . . . . 74.41 110.363 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.0 mt -65.35 -39.75 92.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.622 -0.717 . . . . 73.32 111.432 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 83.4 m -61.47 -39.57 91.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.988 0.423 . . . . 75.32 110.788 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.07 -31.49 72.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.088 0.47 . . . . 72.34 110.512 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.0 mt -84.67 -55.62 4.02 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.741 . . . . 71.32 111.695 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.453 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 49.2 m-85 -109.42 19.55 19.21 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.104 0.779 . . . . 71.14 113.104 -166.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.638 ' HB2' ' O ' ' A' ' 51' ' ' THR . 60.9 t30 -54.82 -47.48 74.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.175 0.512 . . . . 63.53 111.285 177.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.98 -17.6 56.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.113 -0.494 . . . . 73.41 111.169 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.513 ' HB2' HG23 ' A' ' 60' ' ' VAL . 9.3 ptt180 -128.26 73.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.073 0.464 . . . . 73.33 110.628 -175.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.748 HG11 ' HG2' ' A' ' 15' ' ' ARG . 1.2 m -90.65 -22.6 0.26 Allowed Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 113.399 0.889 . . . . 63.52 113.399 175.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.505 ' HD3' HG23 ' A' ' 58' ' ' VAL . 3.8 Cg_exo -79.01 49.33 3.12 Favored 'Trans proline' 0 N--CA 1.443 -1.471 0 CA-C-N 120.629 1.26 . . . . 75.0 110.246 164.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.513 HG23 ' HB2' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.01 131.44 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.198 -0.91 . . . . 64.44 110.16 -175.271 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.579 HD23 HG22 ' A' ' 12' ' ' VAL . 2.4 tm? -109.34 118.83 37.69 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.827 -0.624 . . . . 50.01 110.34 -174.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -106.67 136.71 46.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.004 -0.998 . . . . 73.1 110.842 -174.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HG ' ' A' ' 70' ' ' LEU . . . -94.52 111.06 22.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.257 -0.428 . . . . 64.24 111.085 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.965 ' HB ' ' HB3' ' A' ' 9' ' ' LYS . 60.9 t -86.33 98.76 7.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.013 0.435 . . . . 71.22 109.994 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 177.16 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.076 -1.083 . . . . 64.3 108.076 -176.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -106.16 -11.27 16.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.994 -1.003 . . . . 74.15 109.351 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 67.52 86.99 0.13 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 114.767 -1.106 . . . . 72.14 111.584 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -170.5 157.41 5.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.94 -1.027 . . . . 74.45 109.418 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -82.37 133.88 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.688 0.28 . . . . 73.23 110.399 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.496 ' HG ' ' HB2' ' A' ' 63' ' ' ALA . 53.7 mt -92.59 -46.56 7.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.016 0.436 . . . . 75.12 110.395 178.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.0 t -152.46 157.39 41.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.997 -0.547 . . . . 64.34 111.334 -171.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -128.36 128.82 45.25 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.859 -0.793 . . . . 75.43 108.859 173.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 59' ' ' PRO . 60.5 m-85 67.39 143.8 0.04 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.949 0.781 . . . . 63.34 112.021 -176.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 57.91 -124.16 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.752 -1.113 . . . . 71.02 110.519 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.0 tp -171.19 110.85 0.33 Allowed 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.94 -0.304 . . . . 74.52 110.732 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.65 89.6 6.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.937 0.399 . . . . 74.11 110.069 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -57.71 -27.9 63.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.333 -0.849 . . . . 62.33 112.07 -176.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.18 -46.09 62.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 74.31 110.861 -178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.09 -44.83 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.077 -0.51 . . . . 71.03 111.281 -176.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.434 HD11 HD11 ' A' ' 10' ' ' LEU . 6.7 tp -64.99 -28.23 44.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.512 -0.475 . . . . 45.24 109.802 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.34 -36.27 89.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.75 -0.738 . . . . 61.02 111.662 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.98 -26.58 65.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.088 0.471 . . . . 61.11 110.785 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -87.92 -43.14 12.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 72.31 111.344 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.632 HD12 ' HB3' ' A' ' 35' ' ' SER . 1.3 mm? -76.07 -37.32 58.39 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.511 0.56 . . . . 75.34 112.511 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 121.156 -0.218 . . . . 55.34 110.934 -177.092 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 110.137 -0.32 . . . . 74.25 110.137 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -83.57 82.84 8.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.916 0.388 . . . . 75.04 111.543 -177.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -103.22 86.8 2.74 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.006 -1.109 . . . . 71.02 108.006 167.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -73.25 113.63 10.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.93 -1.032 . . . . 73.12 112.181 -166.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.7 m -110.73 147.62 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.514 -0.766 . . . . 72.55 109.845 169.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.486 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 7.4 pt-20 -88.81 161.92 40.04 Favored Pre-proline 0 C--N 1.31 -1.136 0 CA-C-N 115.222 -0.899 . . . . 64.21 110.416 -177.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 92.5 Cg_endo -80.35 167.04 19.79 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.513 2.142 . . . . 74.13 113.155 -172.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.596 ' NE ' ' O ' ' A' ' 85' ' ' SER . 80.7 mtt-85 -107.55 -171.92 1.97 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.419 -0.81 . . . . 72.34 109.522 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 48.8 tttt -149.52 139.43 21.93 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.117 -0.633 . . . . 74.02 112.141 -177.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 80' ' ' ILE . 71.2 mt -113.53 130.29 56.38 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.346 -0.843 . . . . 75.12 110.57 173.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.535 HG23 ' CG2' ' A' ' 64' ' ' VAL . 79.8 t -107.07 133.16 52.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.137 -0.69 . . . . 73.44 109.137 172.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.845 ' HA ' ' O ' ' A' ' 60' ' ' VAL . 11.3 t -96.58 105.56 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.964 0 N-CA-C 109.574 -0.528 . . . . 73.31 109.574 175.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.535 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 12.8 m-85 -78.23 98.71 5.98 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.933 -0.576 . . . . 75.22 110.256 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.643 ' HA2' ' HD3' ' A' ' 59' ' ' PRO . . . -114.31 -171.57 17.31 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.269 -0.967 . . . . 61.14 112.839 -175.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG2' HG11 ' A' ' 58' ' ' VAL . 10.1 ptm180 -161.97 103.42 1.15 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.766 -0.457 . . . . 72.43 109.766 171.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 73.82 -56.03 0.66 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.209 -0.905 . . . . 72.32 112.689 172.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -175.41 158.57 26.02 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.283 -0.961 . . . . 72.22 113.544 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.741 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 41.1 t -171.94 128.04 0.6 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.261 0.625 . . . . 74.23 109.8 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -68.0 -42.29 80.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.473 0.178 . . . . 72.34 111.286 -175.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 16.1 mt -61.83 -30.1 70.61 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.624 -0.262 . . . . 64.21 111.182 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.535 ' O ' HG13 ' A' ' 25' ' ' ILE . 51.4 t -55.93 -50.94 69.35 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.352 -0.24 . . . . 55.25 110.352 177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.24 -39.13 85.61 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.033 -0.531 . . . . 72.31 111.013 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.09 -39.34 89.93 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.841 -0.618 . . . . 73.43 111.136 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.436 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 15.2 mtp -71.9 -39.18 69.72 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.516 -0.474 . . . . 73.51 110.311 177.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 72.9 mt -54.84 -50.01 64.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 121.347 -0.141 . . . . 54.12 110.759 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.86 84.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.881 0.372 . . . . 74.3 111.17 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.2 m -66.96 -44.71 79.82 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.077 -0.51 . . . . 72.32 110.838 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.42 HD12 ' CZ ' ' A' ' 37' ' ' PHE . 4.2 mm? -67.68 -32.18 72.66 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.32 -0.4 . . . . 72.22 111.31 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 10.0 mmm180 -57.98 -39.02 77.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.038 0.446 . . . . 65.13 110.814 178.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.464 ' HA ' ' CE ' ' A' ' 33' ' ' LYS . 80.4 t -67.84 -42.18 85.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.993 -0.549 . . . . 41.23 110.949 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.99 -35.08 77.74 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.808 -0.441 . . . . 75.44 109.808 176.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 35' ' ' SER . 23.7 tt0 -60.86 -26.59 67.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.584 -0.735 . . . . 63.43 110.656 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.464 ' CE ' ' HA ' ' A' ' 30' ' ' VAL . 54.3 mtmt -74.97 -11.23 60.06 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.636 -0.711 . . . . 71.11 111.383 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.11 -44.74 4.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 60.12 109.842 173.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 32' ' ' GLN . 17.6 m -131.21 115.92 16.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.863 -0.608 . . . . 73.54 110.055 -177.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.4 t-105 -77.24 132.64 38.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.123 0.487 . . . . 61.5 111.344 -177.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.605 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 16.6 p90 -139.99 19.0 2.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.708 -0.678 . . . . 55.15 111.062 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 9' ' ' LYS . 10.2 mm-40 60.82 -179.61 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.946 0.403 . . . . 64.24 111.286 -177.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -151.14 110.59 3.98 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.28 -0.637 . . . . 74.44 109.28 173.023 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -121.72 145.03 48.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.513 -0.312 . . . . 54.43 110.324 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.4 117.8 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.961 -0.385 . . . . 71.41 109.961 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -133.43 128.21 54.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.27 -0.423 . . . . 75.23 110.459 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.643 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 98.7 m-20 -83.54 128.71 34.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 63.32 110.46 176.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 51' ' ' THR . 20.2 pt -64.75 -47.51 88.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.208 -0.451 . . . . 70.51 109.994 175.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.43 ' N ' HG13 ' A' ' 44' ' ' ILE . 36.5 t70 44.57 -97.15 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.33 1.052 . . . . 74.32 113.629 173.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.09 -3.97 63.31 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.931 -0.652 . . . . 73.02 113.44 -171.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -80.93 84.35 6.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.75 -0.463 . . . . 71.21 109.75 178.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -53.27 -32.51 48.94 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 73.4 111.124 -177.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -55.4 -46.95 76.56 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.838 -0.619 . . . . 72.41 110.457 175.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 77.4 mt -78.5 -39.88 36.89 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.273 -0.421 . . . . 71.24 110.876 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.609 ' HA ' HD12 ' A' ' 44' ' ' ILE . 6.9 m -56.34 -42.0 77.01 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.369 -0.378 . . . . 73.32 111.809 -177.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.22 -34.99 77.54 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.294 0.568 . . . . 72.2 111.095 178.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.9 mt -78.6 -48.52 14.98 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.442 -0.799 . . . . 74.43 111.33 -176.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.469 ' O ' HG13 ' A' ' 58' ' ' VAL . 62.4 m-85 -114.18 14.79 18.25 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.031 0.752 . . . . 71.32 113.031 -167.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.583 ' HB2' ' O ' ' A' ' 51' ' ' THR . 27.5 t-20 -53.45 -54.02 42.96 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.171 0.442 . . . . 52.4 111.3 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -87.8 -0.48 57.0 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.44 110.461 -179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.737 ' O ' HG22 ' A' ' 60' ' ' VAL . 0.2 OUTLIER -108.52 5.26 25.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.716 -0.674 . . . . 73.35 110.647 -172.767 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.91 ' HB ' ' CD ' ' A' ' 59' ' ' PRO . 2.6 m -54.85 -171.24 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 114.804 1.409 . . . . 73.14 114.804 -163.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.91 ' CD ' ' HB ' ' A' ' 58' ' ' VAL . 17.6 Cg_exo -7.07 82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.428 -2.334 0 C-N-CA 122.507 2.138 . . . . 54.3 113.828 -129.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.845 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -90.53 160.26 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 122.551 0.341 . . . . 63.41 111.327 -171.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.574 HD23 HG22 ' A' ' 12' ' ' VAL . 24.6 mt -97.46 103.03 14.92 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.281 0.562 . . . . 62.14 109.707 169.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 70.2 t80 -93.68 128.3 39.8 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.056 -0.975 . . . . 71.25 110.777 -177.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.409 ' HB1' ' CE1' ' A' ' 83' ' ' TYR . . . -78.13 102.82 7.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.027 -0.533 . . . . 72.42 110.273 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.535 ' CG2' HG23 ' A' ' 11' ' ' VAL . 61.7 t -66.47 146.5 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.729 -0.669 . . . . 63.22 110.874 -176.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 93.7 m-20 81.0 -31.67 0.11 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.176 0.99 . . . . 73.01 112.729 176.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -98.76 -9.57 24.3 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 121.17 -0.212 . . . . 74.4 111.505 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 27.8 t70 48.08 73.47 0.21 Allowed 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.48 0.657 . . . . 73.34 111.642 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -160.26 148.75 16.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.606 -0.725 . . . . 35.42 110.095 -177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -95.95 127.62 42.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.294 -0.632 . . . . 74.41 109.294 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.09 -70.12 0.59 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.622 -0.511 . . . . 65.43 109.622 177.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 50.0 t 178.16 140.38 0.09 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.385 -0.825 . . . . 64.24 108.936 177.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 21' ' ' CYS . 6.8 t60 -144.07 130.82 20.22 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.099 -0.64 . . . . 65.02 110.951 170.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.468 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 2.1 m-85 174.59 -70.72 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 O-C-N 125.314 1.634 . . . . 74.0 107.718 173.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.481 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 41.0 m-85 -114.12 -74.52 0.62 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.885 -0.598 . . . . 73.54 110.118 175.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 18.0 tp 175.64 141.95 0.06 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.532 0.333 . . . . 71.42 110.162 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -95.21 -42.52 8.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.387 -0.369 . . . . 65.45 110.617 176.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.6 m 62.19 20.74 11.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.741 -0.663 . . . . 74.03 111.932 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -139.06 -53.27 0.57 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.615 -0.434 . . . . 70.24 111.092 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.08 -39.25 82.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.969 -0.56 . . . . 73.11 109.71 177.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.58 HD11 HD11 ' A' ' 10' ' ' LEU . 8.1 tp -66.85 -34.55 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.937 -0.574 . . . . 62.44 109.835 174.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -65.49 -37.72 94.03 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.63 -0.795 . . . . 73.34 111.242 177.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.29 -46.22 81.28 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.437 -0.382 . . . . 64.41 110.759 174.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.409 ' CE1' ' HB1' ' A' ' 63' ' ' ALA . 63.7 t80 -67.66 -43.68 79.68 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.087 -0.506 . . . . 65.13 111.72 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -71.26 13.76 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.327 0.491 . . . . 73.33 112.327 -173.378 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.596 ' O ' ' NE ' ' A' ' 8' ' ' ARG . 18.8 m . . . . . 0 C--N 1.322 -0.602 0 N-CA-C 109.775 -0.454 . . . . 74.23 109.775 174.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.482 1.175 0 CA-C-O 120.644 0.259 . . . . 73.24 110.313 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -77.82 -58.14 3.42 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.472 -0.936 . . . . 70.53 108.472 173.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.474 ' OD1' ' HG3' ' A' ' 4' ' ' GLN . 25.7 t-20 -102.95 142.09 34.65 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 107.853 -1.165 . . . . 60.11 107.853 166.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.474 ' HG3' ' OD1' ' A' ' 3' ' ' ASN . 46.0 mt-30 68.75 102.07 0.06 Allowed 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 122.102 0.953 . . . . 70.04 110.088 -174.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.4 m -113.95 -176.31 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 CA-C-N 114.589 -1.187 . . . . 74.24 111.525 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -75.62 150.87 84.68 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.053 -0.976 . . . . 75.41 109.683 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -76.15 157.97 37.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.661 2.241 . . . . 72.35 113.196 -167.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 83' ' ' TYR . 48.7 mtt180 -95.1 -172.02 2.57 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.511 -0.768 . . . . 72.44 109.334 175.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.6 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 87.5 tttt -145.58 140.64 27.55 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.335 0.588 . . . . 73.02 111.685 -177.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.546 HD11 ' CD1' ' A' ' 80' ' ' ILE . 61.5 mt -116.91 129.71 56.24 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.092 -0.958 . . . . 74.21 110.427 174.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -105.82 126.66 61.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 116.017 -0.538 . . . . 74.13 109.784 173.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.672 HG22 HD23 ' A' ' 61' ' ' LEU . 95.9 t -96.95 114.53 34.14 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.137 -0.483 . . . . 73.33 109.949 177.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.499 ' HB2' HG23 ' A' ' 60' ' ' VAL . 51.9 m-85 -91.9 122.72 34.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.108 -0.496 . . . . 72.41 110.533 177.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -141.75 166.03 26.33 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 109.818 -1.313 . . . . 62.42 109.818 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -83.44 -68.82 0.68 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 118.414 1.107 . . . . 54.15 110.093 -178.24 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.615 ' HA ' ' ND2' ' A' ' 43' ' ' ASN . 1.8 mp0 -121.94 -77.24 0.59 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.2 -0.454 . . . . 44.11 110.114 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -154.04 154.91 25.83 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.389 -0.684 . . . . 52.33 111.389 178.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.8 t -162.5 145.66 11.32 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.843 -0.428 . . . . 51.12 109.843 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 32.8 m-70 -62.85 -36.19 82.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.696 -0.229 . . . . 65.14 111.215 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -32.39 72.61 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.861 0.363 . . . . 74.25 110.759 178.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.447 ' O ' HG13 ' A' ' 25' ' ' ILE . 49.8 t -68.35 -42.1 79.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.217 -0.447 . . . . 60.55 109.8 176.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.37 -40.27 96.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.001 -0.545 . . . . 71.11 111.168 177.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 19' ' ' HIS . 12.0 mm-40 -60.39 -47.06 87.73 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.109 0.481 . . . . 74.0 109.893 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.568 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.1 mtp -61.75 -49.66 75.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.732 -0.667 . . . . 74.44 111.373 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 75.0 mt -55.84 -45.63 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.854 -0.157 . . . . 71.32 111.4 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.7 -37.15 78.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.986 0.422 . . . . 74.13 110.93 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.5 m -69.71 -38.4 76.93 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.61 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 24' ' ' MET . 82.3 mt -63.76 -39.29 93.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 53.52 110.828 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 1.0 OUTLIER -59.41 -38.29 80.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.097 0.475 . . . . 75.33 110.701 -179.237 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.96 -38.56 72.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.863 -0.608 . . . . 73.34 110.418 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -67.67 -32.65 73.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 74.32 111.438 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.5 mt-30 -59.63 -20.99 59.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.901 0.381 . . . . 63.34 111.432 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.73 -33.1 64.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 62.45 110.992 176.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.73 -38.64 11.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.171 0.51 . . . . 71.53 110.489 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.681 ' HB3' HD12 ' A' ' 84' ' ' LEU . 36.2 m -147.34 113.78 5.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.827 -0.624 . . . . 72.21 109.983 -177.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.84 128.54 33.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.025 0.441 . . . . 75.22 110.983 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.594 ' HB3' HD21 ' A' ' 84' ' ' LEU . 3.9 p90 -136.61 21.94 3.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.635 -0.711 . . . . 60.23 110.651 177.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.6 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 11.1 mm-40 58.51 -176.8 0.08 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.128 0.49 . . . . 64.05 110.576 -176.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.7 tp -152.62 109.84 3.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.4 -0.363 . . . . 72.14 110.197 170.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 42' ' ' ILE . 33.2 tt0 -121.31 118.73 30.25 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.046 -0.525 . . . . 63.23 109.593 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 57.0 t -106.9 112.31 39.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.612 -0.514 . . . . 64.43 109.612 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.414 HD11 ' OE2' ' A' ' 40' ' ' GLU . 65.9 mt -111.2 116.66 53.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.025 -0.534 . . . . 73.0 110.727 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.615 ' ND2' ' HA ' ' A' ' 16' ' ' GLU . 14.6 m120 -76.55 116.98 17.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.809 -0.632 . . . . 64.43 111.06 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 17.9 pt -77.04 -38.65 28.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.965 -0.561 . . . . 74.45 109.83 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.403 ' H ' ' HA ' ' A' ' 15' ' ' ARG . 37.1 t70 32.33 -96.42 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.575 1.172 . . . . 71.13 112.988 -177.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.74 34.79 3.63 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.861 -0.685 . . . . 35.15 112.469 -177.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.418 ' OD1' ' HB2' ' A' ' 49' ' ' HIS . 26.5 t-20 -85.18 116.81 23.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.584 -0.525 . . . . 72.14 109.584 176.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -57.01 -25.05 57.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.849 0.685 . . . . 55.21 112.849 -174.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.418 ' HB2' ' OD1' ' A' ' 47' ' ' ASN . 92.5 m-70 -77.8 -58.09 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.354 -0.538 . . . . 72.41 110.768 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.5 mt -78.78 -39.58 35.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.61 0.596 . . . . 64.01 112.61 -172.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.597 ' HA ' HD12 ' A' ' 44' ' ' ILE . 87.9 m -60.69 -48.76 80.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.834 0.35 . . . . 73.14 110.966 -178.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.4 mtt180 -64.43 -29.39 70.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.916 0.389 . . . . 71.15 110.912 -179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 62.5 mt -80.09 -50.67 10.01 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.386 0.513 . . . . 75.3 112.386 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -109.04 -1.87 18.58 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.328 1.233 . . . . 74.14 114.328 -165.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -73.19 89.25 1.51 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 118.916 0.78 . . . . 72.21 112.004 -175.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -136.75 -85.42 0.33 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.308 -0.86 . . . . 72.34 109.177 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -139.59 81.44 1.83 Allowed 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 105.761 -1.941 . . . . 75.55 105.761 171.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.515 HG23 ' HD3' ' A' ' 59' ' ' PRO . 0.1 OUTLIER -51.09 -84.86 0.0 OUTLIER Pre-proline 0 CA--C 1.507 -0.685 0 CA-C-N 114.435 -1.257 . . . . 63.51 114.365 -157.203 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.515 ' HD3' HG23 ' A' ' 58' ' ' VAL . 51.0 Cg_exo -21.08 78.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.569 0 C-N-CA 122.718 2.279 . . . . 64.01 114.223 -144.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -99.56 133.41 42.49 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 115.592 -0.731 . . . . 75.43 111.267 -170.374 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.672 HD23 HG22 ' A' ' 12' ' ' VAL . 58.1 mt -88.27 106.48 18.24 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.294 0.568 . . . . 72.13 109.694 170.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -91.31 121.97 33.52 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.309 -0.86 . . . . 74.24 109.868 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.5 100.89 6.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.85 -0.614 . . . . 34.32 110.465 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 52.8 t -67.89 161.57 3.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.315 -0.624 . . . . 75.44 109.315 177.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 32.1 m-80 79.68 -46.81 0.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.184 0.594 . . . . 74.23 111.618 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -94.3 -26.39 16.61 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.807 0.337 . . . . 73.53 110.258 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 60.99 82.21 0.17 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.316 -0.856 . . . . 72.51 111.791 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -165.11 166.41 19.13 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.261 -0.881 . . . . 72.24 110.112 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -94.17 127.98 40.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 72.44 110.393 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 80.4 mt -100.91 -82.19 0.46 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.537 0.684 . . . . 61.1 111.733 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 37.8 t -135.8 148.69 48.83 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.167 -0.924 . . . . 53.42 110.65 -169.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -145.2 163.19 35.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.74 -0.209 . . . . 75.14 111.236 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 82.85 -77.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.616 0.969 . . . . 70.44 113.616 171.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -114.46 -0.35 13.78 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.737 0.643 . . . . 75.25 112.737 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.6 tp 66.93 108.27 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.512 0.673 . . . . 64.01 111.371 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -80.68 -21.8 40.99 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.989 -0.551 . . . . 54.12 110.8 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.7 m 70.82 -54.19 0.66 Allowed 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.704 0.627 . . . . 75.2 111.809 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -60.39 -45.6 92.96 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.005 0.372 . . . . 63.41 112.005 -176.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 87.1 t -62.13 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.393 -0.367 . . . . 75.44 111.977 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.839 HD11 HD23 ' A' ' 84' ' ' LEU . 5.5 tp -71.84 -34.53 51.72 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.351 0 C-N-CA 120.3 -0.56 . . . . 71.32 109.804 178.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -61.35 -35.25 90.69 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.649 -0.786 . . . . 45.13 111.731 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.32 72.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.984 0.421 . . . . 64.44 111.191 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.456 ' CZ ' ' HD3' ' A' ' 8' ' ' ARG . 20.2 t80 -87.76 -47.73 8.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.452 . . . . 71.21 111.712 178.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.839 HD23 HD11 ' A' ' 80' ' ' ILE . 0.2 OUTLIER -69.46 -37.43 77.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.102 -0.499 . . . . 71.41 111.889 -171.396 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 110.487 -0.19 . . . . 75.31 110.487 -179.329 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.0 mtm . . . . . 0 N--CA 1.483 1.223 0 N-CA-C 109.661 -0.496 . . . . 73.25 109.661 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -74.2 49.15 0.34 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.405 0.621 . . . . 74.22 111.042 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -112.04 96.65 6.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.618 -0.719 . . . . 72.31 109.478 -177.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -70.45 122.87 20.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.032 0.92 . . . . 73.22 111.409 -175.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.1 m -124.61 119.72 56.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 114.631 -1.168 . . . . 64.43 108.98 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -129.89 153.67 80.98 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.129 -0.487 . . . . 70.23 110.935 -170.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.35 152.9 61.35 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.871 2.381 . . . . 62.33 113.282 -173.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' ' O ' ' A' ' 85' ' ' SER . 2.4 ptp180 -115.24 150.04 36.8 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.264 -0.88 . . . . 74.23 108.64 177.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.615 ' HG2' ' HG3' ' A' ' 38' ' ' GLU . 47.1 mtpt -100.38 135.96 41.01 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.643 0.609 . . . . 75.45 112.643 -172.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.714 HD11 HD11 ' A' ' 80' ' ' ILE . 73.5 mt -103.63 130.52 51.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.372 -0.831 . . . . 65.44 110.038 170.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 40' ' ' GLU . 53.4 t -107.9 128.64 63.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.981 -0.554 . . . . 61.11 110.445 175.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.517 HG22 HD23 ' A' ' 61' ' ' LEU . 86.2 t -96.46 119.5 44.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 N-CA-C 109.106 -0.701 . . . . 74.43 109.106 174.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB2' HG12 ' A' ' 60' ' ' VAL . 4.6 m-85 -78.47 97.02 5.55 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.015 0.436 . . . . 73.1 110.811 -179.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.542 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -80.44 160.62 43.98 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.81 -0.71 . . . . 72.31 112.539 -174.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 1.011 ' HB2' HG11 ' A' ' 58' ' ' VAL . 34.9 ttp180 -144.94 -0.67 0.89 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.077 -0.712 . . . . 74.14 109.077 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 59.18 170.66 0.07 Allowed 'General case' 0 C--O 1.236 0.391 0 CA-C-N 114.731 -1.122 . . . . 62.22 111.033 -169.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.23 -56.94 4.88 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.808 -0.711 . . . . 52.13 113.632 175.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.9 t -69.17 113.47 6.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.085 0.469 . . . . 73.22 110.97 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -71.46 -28.29 63.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.871 -0.604 . . . . 74.41 111.198 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 73' ' ' TYR . 18.6 mt -54.4 -30.19 51.36 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.624 0.231 . . . . 75.22 111.624 178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.417 ' O ' HG13 ' A' ' 25' ' ' ILE . 71.0 m -56.08 -38.74 71.1 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.671 0.272 . . . . 71.42 110.731 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -71.29 -33.46 69.75 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.731 0.3 . . . . 75.23 110.629 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LEU . 8.3 mm-40 -56.24 -45.05 80.17 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.081 -0.509 . . . . 71.33 110.077 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.616 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 81.7 mmm -67.0 -41.47 86.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.517 -0.765 . . . . 43.25 110.137 178.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 21' ' ' CYS . 79.1 mt -56.82 -45.26 83.12 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 115.938 -0.573 . . . . 71.05 110.805 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.45 87.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.903 0.382 . . . . 75.11 110.69 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 m -61.59 -42.86 99.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.083 -0.508 . . . . 54.2 110.958 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 24' ' ' MET . 73.8 mt -64.06 -37.6 88.04 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.209 -0.45 . . . . 72.41 110.915 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.2 mmm180 -61.24 -42.4 98.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.254 -0.43 . . . . 75.03 110.893 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.567 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 97.9 t -71.61 -39.43 69.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.622 178.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HA ' HD23 ' A' ' 31' ' ' LEU . 14.2 mt -66.71 -34.79 78.62 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.377 -0.374 . . . . 72.21 111.443 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.555 HE22 ' HB2' ' A' ' 39' ' ' LEU . 24.4 mt-30 -59.87 -20.99 60.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.77 0.319 . . . . 72.43 111.37 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.567 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 51.9 mtmt -82.02 -15.86 52.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.182 0.515 . . . . 63.04 111.191 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -106.43 -46.2 4.08 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.481 0.658 . . . . 71.33 109.743 178.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.559 ' HB3' HD12 ' A' ' 84' ' ' LEU . 50.9 m -141.19 113.22 7.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.884 -1.053 . . . . 72.15 109.319 -175.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -79.22 129.22 34.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.989 0.423 . . . . 64.52 111.7 -175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.573 ' HB3' HD11 ' A' ' 84' ' ' LEU . 3.1 p90 -138.27 18.42 2.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.997 -0.547 . . . . 74.4 111.282 178.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.615 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 12.0 mm-40 57.84 -178.55 0.06 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.329 0.585 . . . . 73.11 111.159 -176.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.555 ' HB2' HE22 ' A' ' 32' ' ' GLN . 5.8 tp -150.7 117.3 5.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.053 -0.521 . . . . 74.22 110.36 171.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB3' HG22 ' A' ' 11' ' ' VAL . 29.7 tt0 -126.47 123.51 38.0 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.557 -0.747 . . . . 71.25 109.568 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 49.1 t -104.74 120.25 54.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.472 -0.331 . . . . 43.3 110.153 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 11' ' ' VAL . 75.7 mt -124.71 110.41 24.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.381 -0.372 . . . . 62.52 110.333 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 10.2 m120 -69.62 122.81 19.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.265 0.555 . . . . 75.23 111.829 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.584 HD13 ' HB2' ' A' ' 54' ' ' TYR . 44.8 pt -86.57 -10.05 11.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.856 -0.611 . . . . 61.41 110.445 178.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.436 ' OD1' ' HA ' ' A' ' 15' ' ' ARG . 5.6 p-10 -73.53 -7.12 50.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.014 0.435 . . . . 74.23 110.32 177.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -97.36 -2.95 58.83 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.156 -0.778 . . . . 74.33 111.156 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -131.59 97.52 4.25 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.426 -0.583 . . . . 63.11 109.426 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.92 -24.67 67.96 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 113.307 0.855 . . . . 54.34 113.307 -169.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -75.27 -41.67 56.73 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.231 -0.588 . . . . 64.12 110.171 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.91 -31.5 72.7 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.51 -0.313 . . . . 75.5 110.594 173.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.479 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 45.5 m -53.43 -57.16 11.62 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.069 -0.514 . . . . 53.45 111.326 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.0 mtt-85 -63.93 -31.28 72.41 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.025 0.44 . . . . 65.32 111.62 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.7 mt -68.11 -39.86 82.69 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.333 0.494 . . . . 70.43 112.333 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.584 ' HB2' HD13 ' A' ' 44' ' ' ILE . 66.5 m-85 -131.47 19.34 4.77 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 112.44 0.533 . . . . 75.42 112.44 -172.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 51' ' ' THR . 45.2 t30 -52.13 -53.35 43.8 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.051 0.453 . . . . 74.41 111.846 -176.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -93.25 11.88 26.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.749 -0.659 . . . . 72.5 110.365 -178.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.724 ' O ' ' HB ' ' A' ' 60' ' ' VAL . 72.7 mtm180 -135.49 50.82 2.1 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 108.773 -0.825 . . . . 75.33 108.773 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.011 HG11 ' HB2' ' A' ' 15' ' ' ARG . 1.4 m -89.27 -24.28 0.29 Allowed Pre-proline 0 CA--C 1.515 -0.39 0 N-CA-C 114.078 1.14 . . . . 75.15 114.078 -178.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.905 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 8.3 Cg_exo -75.08 52.02 2.97 Favored 'Trans proline' 0 N--CA 1.44 -1.64 0 CA-C-N 121.025 1.402 . . . . 74.01 110.039 165.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 57' ' ' ARG . 0.4 OUTLIER -111.46 150.53 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 CA-C-N 114.893 -1.049 . . . . 73.33 110.141 -171.048 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 70' ' ' LEU . 91.6 mt -113.28 122.14 46.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.896 0.379 . . . . 63.03 111.18 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.552 ' HB3' ' HB ' ' A' ' 11' ' ' VAL . 91.2 t80 -99.61 125.26 45.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.965 -0.561 . . . . 73.51 109.931 175.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.644 ' HB3' ' HG2' ' A' ' 68' ' ' LYS . . . -84.88 106.95 16.78 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.895 0.379 . . . . 74.41 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 97.3 t -78.89 93.83 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.04 -0.527 . . . . 65.24 110.093 177.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 33.9 t-20 170.89 -49.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 72.43 109.206 -177.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -119.64 -11.63 9.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.596 -0.729 . . . . 74.12 111.026 -176.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 66.69 89.57 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.429 0.633 . . . . 75.44 109.725 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 63' ' ' ALA . 19.3 ptmt -167.9 150.57 5.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 72.54 109.913 -175.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.76 135.41 34.14 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.753 -0.462 . . . . 64.23 109.753 175.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.772 ' HB2' ' HB2' ' A' ' 61' ' ' LEU . 3.1 mm? -79.14 -70.99 0.47 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.779 -0.646 . . . . 53.15 110.496 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.492 ' SG ' HD12 ' A' ' 75' ' ' LEU . 8.4 p -152.97 -178.91 7.21 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.388 -0.824 . . . . 71.43 110.101 -178.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 p80 -118.38 -170.93 1.98 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.851 -0.613 . . . . 53.43 110.242 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.905 ' HB3' ' HG2' ' A' ' 59' ' ' PRO . 21.1 p90 -41.9 135.16 2.43 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 123.769 0.668 . . . . 74.52 111.378 176.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.486 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 56.6 m-85 71.87 94.13 0.08 Allowed 'General case' 0 C--O 1.231 0.127 0 O-C-N 124.119 0.887 . . . . 73.3 109.353 -173.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.492 HD12 ' SG ' ' A' ' 71' ' ' CYS . 38.4 tp -53.58 123.86 13.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.07 -1.423 . . . . 72.33 113.849 -166.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.443 ' HB2' ' HB3' ' A' ' 71' ' ' CYS . 4.4 m-20 -80.9 94.24 6.45 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.081 -1.081 . . . . 72.11 108.081 167.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 15.1 m -67.85 -36.43 80.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.721 -0.672 . . . . 72.52 111.515 -169.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.55 -43.46 98.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.815 0.341 . . . . 54.32 111.228 179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.2 -46.92 86.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.159 -0.473 . . . . 62.03 111.598 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.714 HD11 HD11 ' A' ' 10' ' ' LEU . 7.8 tp -66.93 -37.22 78.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.034 -0.666 . . . . 71.42 110.431 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.85 -37.2 93.31 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.578 -0.82 . . . . 53.52 111.661 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.97 -47.46 83.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.879 0.371 . . . . 75.24 110.843 177.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -72.6 -34.25 67.27 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.002 -0.545 . . . . 74.52 111.767 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -84.41 11.05 9.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.409 -0.359 . . . . 75.45 111.859 -174.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.774 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 50.0 m . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.162 -0.681 . . . . 65.43 109.162 172.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.993 0.425 . . . . 74.54 110.454 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -123.76 -32.81 3.26 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.013 -0.539 . . . . 74.12 110.089 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -123.73 151.02 43.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.213 -0.448 . . . . 71.23 111.267 -177.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -123.46 156.39 35.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.854 -0.612 . . . . 54.41 109.48 175.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -99.89 178.58 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.175 0.512 . . . . 54.51 111.463 -177.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.618 ' HB2' ' HD2' ' A' ' 7' ' ' PRO . 9.7 pt-20 -112.96 168.16 8.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.0 -1.0 . . . . 74.3 109.324 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 6' ' ' GLU . 74.4 Cg_endo -73.8 154.51 48.73 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.057 1.838 . . . . 60.43 113.153 -174.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.899 ' NH1' ' O ' ' A' ' 85' ' ' SER . 9.5 ptp180 -109.54 116.22 31.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.746 -0.661 . . . . 73.15 109.602 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 38' ' ' GLU . 82.7 tttt -74.78 140.12 43.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.877 0.695 . . . . 74.21 112.877 -168.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.694 HD11 HD11 ' A' ' 80' ' ' ILE . 32.8 mt -113.08 145.89 40.12 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.203 -0.908 . . . . 74.34 110.736 172.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 62' ' ' PHE . 55.9 t -119.73 138.53 50.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.004 -0.544 . . . . 71.31 109.937 174.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.651 HG22 HD23 ' A' ' 61' ' ' LEU . 65.9 t -113.57 119.97 62.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 N-CA-C 110.165 -0.309 . . . . 74.43 110.165 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 1.024 ' HB2' HG23 ' A' ' 60' ' ' VAL . 63.8 m-85 -83.64 113.87 21.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.526 -0.546 . . . . 75.31 109.526 174.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -124.01 -173.74 13.97 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.617 -0.593 . . . . 74.22 111.617 -177.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.402 ' HB2' ' HB2' ' A' ' 45' ' ' ASP . 6.2 ptm85 -159.2 154.89 26.11 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.821 0.343 . . . . 74.31 110.715 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -73.44 72.62 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.541 -0.754 . . . . 71.12 109.686 174.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.56 61.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.672 -0.695 . . . . 73.45 111.926 -178.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.4 t -172.06 114.37 0.33 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.889 -0.782 . . . . 50.25 108.889 176.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -70.99 -35.46 72.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.345 -0.389 . . . . 65.14 111.826 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -52.95 -29.2 27.45 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.929 0.714 . . . . 63.25 112.929 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 62.6 m -54.99 -32.93 62.12 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.623 0.249 . . . . 73.02 111.045 178.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -64.15 -50.34 68.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.381 -0.372 . . . . 63.24 110.401 178.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -55.12 -49.44 71.75 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.518 -0.764 . . . . 54.15 111.241 179.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.549 ' HG2' ' O ' ' A' ' 74' ' ' PHE . 63.7 mtp -59.09 -54.28 48.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 71.11 111.115 -179.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.69 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 84.1 mt -56.12 -50.59 69.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 73.52 111.407 -177.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -37.81 73.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.958 0.409 . . . . 72.42 111.142 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.4 m -69.11 -43.48 74.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.97 -0.559 . . . . 65.54 110.879 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 24' ' ' MET . 80.4 mt -65.38 -38.38 89.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.03 111.424 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.69 ' HG2' ' O ' ' A' ' 25' ' ' ILE . 11.5 mmm180 -58.07 -35.65 71.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 71.34 111.01 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 69.7 t -77.32 -32.71 19.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.328 -0.396 . . . . 74.44 110.608 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.26 -30.68 66.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.037 0.446 . . . . 75.23 109.859 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 28' ' ' LEU . 99.6 mt-30 -59.93 -20.83 59.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.88 -0.6 . . . . 71.41 111.252 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -81.21 -15.54 55.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.026 0.441 . . . . 63.12 110.855 179.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -96.97 -49.29 5.08 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.319 -0.623 . . . . 65.32 109.319 174.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 17.9 m -140.88 119.8 12.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.025 -0.989 . . . . 72.34 109.366 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.2 t-105 -79.26 131.68 36.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.039 0.447 . . . . 74.44 110.618 -178.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' HD12 ' A' ' 10' ' ' LEU . 9.1 p90 -139.15 16.58 2.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.806 -0.634 . . . . 73.4 111.582 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.501 ' HB2' ' HG3' ' A' ' 9' ' ' LYS . 15.6 mm-40 59.94 178.5 0.09 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.991 0.424 . . . . 72.24 110.611 -176.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.9 tp -153.19 110.12 3.45 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 120.264 -0.574 . . . . 72.43 110.88 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -115.87 118.63 33.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.97 -0.559 . . . . 72.42 109.97 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.8 t -105.4 113.84 43.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 110.085 -0.339 . . . . 40.11 110.085 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.7 mt -113.05 114.85 48.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.148 -0.478 . . . . 74.44 110.869 -176.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -73.04 118.24 15.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.659 -0.701 . . . . 72.53 111.509 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.524 HD13 ' HB2' ' A' ' 54' ' ' TYR . 28.9 pt -86.11 -25.27 6.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.07 -0.514 . . . . 73.33 111.804 -179.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 15' ' ' ARG . 32.9 t70 -67.49 -23.51 65.49 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.978 0.418 . . . . 73.31 111.55 -172.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.89 19.38 30.11 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.993 -0.622 . . . . 74.24 111.828 175.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -142.27 119.39 11.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.378 -0.601 . . . . 54.22 109.378 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -55.52 -37.52 68.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 62.42 111.26 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.51 -52.75 9.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.158 -0.473 . . . . 65.13 110.966 -174.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.428 HD23 HD12 ' A' ' 53' ' ' LEU . 48.4 mt -64.11 -33.73 76.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.519 -0.31 . . . . 61.22 111.573 -177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.57 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 88.1 m -57.85 -53.21 60.77 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 120.845 0.355 . . . . 64.54 110.368 175.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.88 -31.48 72.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.27 -0.423 . . . . 74.31 111.402 -178.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.428 HD12 HD23 ' A' ' 50' ' ' LEU . 72.1 mt -71.55 -48.35 49.08 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.381 0.512 . . . . 54.5 112.381 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.555 ' CD2' HG21 ' A' ' 60' ' ' VAL . 89.6 m-85 -113.94 8.59 17.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.28 0.844 . . . . 75.32 113.28 -169.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.57 ' HB2' ' O ' ' A' ' 51' ' ' THR . 64.2 t30 -59.66 135.86 57.81 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.398 -0.521 . . . . 75.04 111.478 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.3 t70 74.86 -30.93 0.21 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 71.44 112.903 178.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.494 ' HG2' ' OH ' ' A' ' 73' ' ' TYR . 82.8 mtt180 -116.03 37.24 3.73 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 108.364 -0.976 . . . . 75.15 108.364 -175.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.604 ' HB ' ' HD3' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -73.67 -97.57 0.0 OUTLIER Pre-proline 0 N--CA 1.425 -1.717 0 CA-C-N 115.276 -0.875 . . . . 74.5 110.228 -176.228 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.604 ' HD3' ' HB ' ' A' ' 58' ' ' VAL . 65.8 Cg_exo -17.74 75.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 122.535 2.157 . . . . 61.25 113.288 -146.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 1.024 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -111.3 126.16 68.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.916 -1.038 . . . . 70.42 111.699 -165.546 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.651 HD23 HG22 ' A' ' 12' ' ' VAL . 21.5 mt -89.62 112.87 24.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.882 -0.599 . . . . 75.21 110.72 176.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.592 ' CZ ' ' HA ' ' A' ' 67' ' ' ASP . 87.0 t80 -91.79 120.28 32.37 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.522 -0.763 . . . . 71.52 109.761 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.87 102.82 11.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.945 -0.57 . . . . 50.32 110.196 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' ASN . 50.0 t -63.94 146.83 12.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.145 -0.687 . . . . 64.34 109.145 178.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 49.8 m-80 85.18 -29.06 0.08 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.157 0.983 . . . . 70.32 111.047 -177.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.699 ' HB3' ' HD3' ' A' ' 68' ' ' LYS . 28.0 mt-10 -96.7 -37.01 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 121.26 -0.176 . . . . 74.51 111.236 176.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.592 ' HA ' ' CZ ' ' A' ' 62' ' ' PHE . 18.2 t70 68.93 77.77 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.791 0.682 . . . . 75.35 109.896 -176.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.699 ' HD3' ' HB3' ' A' ' 66' ' ' GLU . 16.4 ptmt -179.77 157.82 0.75 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.36 -0.837 . . . . 73.14 109.674 -174.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.8 mp0 -94.9 141.19 28.93 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.566 -0.531 . . . . 73.15 109.566 173.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 63.4 mt -84.07 -66.16 0.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.447 0.642 . . . . 74.21 110.036 176.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 19.3 t -144.29 170.76 15.39 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.865 -0.791 . . . . 74.51 108.865 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.546 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 1.5 p-80 -144.36 174.65 10.73 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 123.006 0.191 . . . . 62.52 111.503 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.494 ' OH ' ' HG2' ' A' ' 57' ' ' ARG . 18.2 m-85 80.05 -81.15 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.173 0.989 . . . . 74.25 112.256 178.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.549 ' O ' ' HG2' ' A' ' 24' ' ' MET . 56.0 m-85 -112.37 -84.5 0.58 Allowed 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 121.023 -0.271 . . . . 62.33 110.846 -173.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 19.4 tp 178.35 147.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.126 -0.488 . . . . 62.22 110.016 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.525 ' O ' HG22 ' A' ' 80' ' ' ILE . 18.6 t70 -141.12 109.74 5.99 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.498 -0.556 . . . . 73.44 109.498 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -62.66 -27.88 69.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.829 -0.623 . . . . 72.43 111.659 -174.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -73.84 -49.53 24.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.967 -0.56 . . . . 65.24 111.446 -175.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.2 t -65.21 -46.97 89.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 45.32 111.796 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.694 HD11 HD11 ' A' ' 10' ' ' LEU . 7.0 tp -69.42 -30.5 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.856 -0.737 . . . . 53.21 109.985 177.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.59 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . -65.42 -19.97 67.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.047 -0.597 . . . . 53.22 111.8 176.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.79 -35.21 60.15 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.127 0.489 . . . . 63.45 110.231 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -86.53 -40.12 15.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 73.41 111.057 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.595 HD23 HD11 ' A' ' 80' ' ' ILE . 1.7 mm? -85.74 13.51 7.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.4 -0.363 . . . . 71.14 111.404 -178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.899 ' O ' ' NH1' ' A' ' 8' ' ' ARG . 4.4 t . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.502 -0.555 . . . . 75.31 109.502 176.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.815 0.341 . . . . 54.44 110.339 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -145.34 116.86 8.06 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.299 -0.63 . . . . 74.2 109.299 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -122.72 132.42 54.24 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.882 0.372 . . . . 73.02 110.558 -178.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -132.53 161.32 34.1 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.522 -0.547 . . . . 75.42 109.522 179.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.6 m -92.88 178.36 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.115 0.483 . . . . 75.42 110.255 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -105.11 156.97 35.29 Favored Pre-proline 0 C--N 1.316 -0.861 0 CA-C-N 115.755 -0.657 . . . . 74.23 109.911 179.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.99 121.28 4.43 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.632 2.221 . . . . 62.34 112.477 -175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -102.99 119.08 38.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.426 -0.806 . . . . 70.53 109.741 177.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 37' ' ' PHE . 57.6 mtpt -73.03 139.0 46.29 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.992 -0.549 . . . . 74.02 112.239 -172.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.597 HD11 HD11 ' A' ' 80' ' ' ILE . 22.3 mt -105.77 119.12 38.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.286 -0.87 . . . . 72.12 109.923 170.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 40' ' ' GLU . 80.9 t -102.07 129.89 52.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.868 -0.605 . . . . 43.15 109.982 177.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.531 HG22 ' CD2' ' A' ' 61' ' ' LEU . 46.3 t -96.33 107.06 19.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 116.068 -0.515 . . . . 61.33 109.731 176.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 1.069 ' HB2' HG23 ' A' ' 60' ' ' VAL . 20.2 m-85 -81.48 116.89 21.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.396 -0.594 . . . . 63.32 109.396 174.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 43' ' ' ASN . . . -147.93 -151.8 5.53 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 111.286 -0.726 . . . . 62.43 111.286 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.415 ' HE ' ' HB2' ' A' ' 15' ' ' ARG . 5.4 ptm180 -171.26 164.64 7.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.96 0.41 . . . . 73.4 110.743 176.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.13 131.09 48.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.531 -0.759 . . . . 74.41 110.704 175.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 101.81 -7.55 55.44 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 23.13 112.863 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -104.53 102.87 12.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.123 0.487 . . . . 73.12 109.827 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -64.61 -33.11 75.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.717 -0.674 . . . . 74.32 110.634 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -59.31 -31.57 69.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.389 -0.369 . . . . 71.32 111.56 -177.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.471 ' O ' HG13 ' A' ' 25' ' ' ILE . 68.3 m -61.04 -42.04 97.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.977 0.418 . . . . 62.54 110.32 178.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -70.53 -35.13 72.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.02 -0.536 . . . . 63.33 110.47 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.49 -34.34 77.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.733 -0.667 . . . . 73.12 110.686 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 10.1 mtt -64.54 -43.97 92.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.098 -0.501 . . . . 72.31 110.893 173.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' CYS . 82.6 mt -54.68 -53.25 33.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 116.315 -0.402 . . . . 75.54 110.92 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.18 -31.07 68.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.444 -0.344 . . . . 74.1 111.416 -179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.7 m -73.33 -46.24 50.53 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.216 -0.447 . . . . 72.11 110.721 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.478 HD11 HD11 ' A' ' 61' ' ' LEU . 9.2 mp -64.94 -35.91 82.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.197 -0.456 . . . . 75.03 111.604 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -56.61 -34.06 66.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.013 0.435 . . . . 75.32 111.257 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.59 ' HA ' ' HE2' ' A' ' 33' ' ' LYS . 77.7 t -76.79 -40.23 31.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.086 -0.506 . . . . 73.23 110.748 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.423 ' HA ' HD23 ' A' ' 31' ' ' LEU . 10.5 mt -62.81 -34.71 77.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.525 -0.307 . . . . 75.04 111.024 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -53.93 -29.34 41.86 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.49 0.494 . . . . 72.11 111.444 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.59 ' HE2' ' HA ' ' A' ' 30' ' ' VAL . 54.7 mtmt -77.23 -11.76 59.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.888 -0.596 . . . . 75.34 111.391 -176.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -108.81 -45.84 3.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.527 0.68 . . . . 71.1 109.496 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.562 ' HB3' HD12 ' A' ' 84' ' ' LEU . 44.4 m -137.39 124.08 21.08 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.02 -0.991 . . . . 74.42 109.629 -175.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -84.23 134.25 34.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.065 0.459 . . . . 75.43 111.597 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 9.5 p90 -147.79 18.23 1.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.769 -0.651 . . . . 71.52 110.957 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HG3' ' HG2' ' A' ' 9' ' ' LYS . 27.2 mm-40 58.53 -169.26 0.13 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.561 -0.29 . . . . 72.44 110.468 -177.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.62 131.03 13.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.796 -0.446 . . . . 61.12 109.796 175.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.603 ' HB3' HG22 ' A' ' 11' ' ' VAL . 5.1 tt0 -146.36 128.23 15.4 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.565 -0.532 . . . . 72.33 109.565 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 55.2 t -118.9 119.39 60.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.892 -0.41 . . . . 71.34 109.892 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.448 HD12 HG11 ' A' ' 11' ' ' VAL . 71.3 mt -127.7 126.15 66.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.466 -0.334 . . . . 74.03 110.971 -174.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' ' 14' ' ' GLY . 94.8 m-20 -76.98 126.95 31.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.591 . . . . 71.4 111.094 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.572 HG12 ' CG1' ' A' ' 58' ' ' VAL . 2.7 pp -79.06 -23.64 12.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.961 -0.563 . . . . 74.52 111.52 -178.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -79.17 -5.48 54.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.389 . . . . 72.21 111.067 -175.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -92.69 -6.58 63.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.791 -0.719 . . . . 71.04 111.762 174.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -127.19 123.92 37.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.653 0.263 . . . . 75.45 110.85 -178.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -50.92 -47.37 60.88 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 71.22 111.492 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -61.12 -48.88 79.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.386 . . . . 75.5 110.818 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.0 mt -73.23 -31.38 64.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.964 -0.562 . . . . 63.35 111.694 -172.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.655 ' O ' ' HB3' ' A' ' 55' ' ' ASN . 31.1 m -61.26 -51.69 67.89 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 121.16 0.505 . . . . 73.34 110.334 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -61.11 -30.74 70.54 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.916 -0.584 . . . . 71.22 111.112 -177.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.77 -34.27 24.82 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.034 0.753 . . . . 72.52 113.034 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -135.85 10.97 3.38 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.443 -0.503 . . . . 70.33 112.283 -165.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 51' ' ' THR . 2.7 p-10 -46.07 -39.09 8.81 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.251 0.834 . . . . 70.12 113.251 -172.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -131.0 21.6 4.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.641 0.734 . . . . 72.44 110.932 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.1 ttm180 -146.17 44.4 1.24 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 107.528 -1.286 . . . . 71.13 107.528 -176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.572 ' CG1' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -78.2 -98.1 0.0 OUTLIER Pre-proline 0 N--CA 1.429 -1.52 0 CA-C-N 115.199 -0.91 . . . . 54.21 111.275 -171.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.705 ' O ' ' HA ' ' A' ' 72' ' ' HIS . 73.0 Cg_exo -20.17 76.84 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.29 0 C-N-CA 122.504 2.136 . . . . 74.15 113.646 -145.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 1.069 HG23 ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -110.42 121.28 62.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-N 115.24 -0.891 . . . . 65.3 111.179 -170.521 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.531 ' CD2' HG22 ' A' ' 12' ' ' VAL . 38.9 mt -83.25 107.55 15.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.15 -0.477 . . . . 71.2 110.742 176.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -92.33 122.54 34.89 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.829 -0.623 . . . . 64.25 110.418 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.08 102.35 10.96 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.728 -0.669 . . . . 61.42 111.208 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.472 ' HB ' ' HB2' ' A' ' 9' ' ' LYS . 29.4 t -81.15 87.29 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.306 0.574 . . . . 54.03 110.184 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 64' ' ' VAL . 23.5 t-20 172.32 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.764 -1.107 . . . . 75.12 108.233 -179.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -99.15 -19.54 17.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.879 -1.055 . . . . 75.13 109.862 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.7 t70 67.37 78.41 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.122 -0.945 . . . . 72.12 111.029 -179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.98 149.32 0.9 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.042 -0.526 . . . . 73.53 110.445 174.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.57 140.09 34.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.941 -0.572 . . . . 73.13 110.415 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -91.6 -81.63 0.32 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.02 0.438 . . . . 75.32 110.838 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 13.4 p -122.82 164.45 18.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.113 -0.494 . . . . 43.34 109.85 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.705 ' HA ' ' O ' ' A' ' 59' ' ' PRO . 45.4 p-80 -144.83 168.03 21.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.43 0.53 . . . . 54.41 112.43 -176.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 26.2 m-85 74.74 -82.5 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.241 1.016 . . . . 72.35 112.231 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 22.9 m-85 -99.48 -79.51 0.49 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.77 -0.372 . . . . 75.14 110.512 -176.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 74' ' ' PHE . 22.2 tp 171.21 147.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.888 0.743 . . . . 54.35 109.716 176.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -123.68 115.37 21.32 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.675 -0.861 . . . . 71.31 108.675 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.7 p -82.04 -2.63 52.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.981 -0.554 . . . . 74.22 112.364 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -107.43 -39.45 5.64 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.94 -0.304 . . . . 72.21 111.092 -176.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.72 -45.04 99.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.601 -0.272 . . . . 60.5 110.69 176.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.597 HD11 HD11 ' A' ' 10' ' ' LEU . 7.3 tp -68.34 -31.47 51.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.532 -0.467 . . . . 54.22 110.09 176.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -67.12 -34.51 86.58 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.646 -0.788 . . . . 62.44 111.704 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.95 -36.7 72.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.987 0.422 . . . . 62.23 110.492 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -81.34 -47.25 13.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.898 -0.592 . . . . 63.2 111.837 -177.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.562 HD12 ' HB3' ' A' ' 35' ' ' SER . 0.3 OUTLIER -79.11 13.41 1.82 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.08 0.4 . . . . 71.21 112.08 -172.045 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.765 -0.457 . . . . 65.14 109.765 176.536 . . . . . . . . 0 0 . 1 stop_ save_